data_1r2a_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 1r2a _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.67 -57.33 5.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.208 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.6 m -52.4 -28.58 20.36 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.242 -0.911 . . . . 0.0 110.262 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -72.04 -59.19 2.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -39.44 69.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.923 . . . . 0.0 110.199 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.0 mt -62.91 -43.99 97.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.95 . . . . 0.0 109.957 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.36 -37.95 65.53 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.16 -0.963 . . . . 0.0 109.653 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.44 -55.24 30.69 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.424 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.6 t80 -48.14 -38.83 18.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.404 -1.057 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.85 -36.52 83.53 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.472 -0.768 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.9 -25.07 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.773 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.6 mt-10 -82.69 -57.15 3.45 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.416 HG12 ' CD1' ' A' ' 30' ' ' LEU . 22.6 t -55.53 -32.91 31.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.126 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.1 -34.53 63.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.261 -0.9 . . . . 0.0 110.233 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.49 -62.59 1.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.204 -0.935 . . . . 0.0 110.362 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.16 -43.12 63.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.216 -0.927 . . . . 0.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.42 62.41 11.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.287 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.23 161.62 45.2 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 O-C-N 123.734 1.386 . . . . 0.0 110.527 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.19 -34.12 10.52 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.638 1.336 . . . . 0.0 110.423 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -129.05 123.85 33.38 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.289 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.416 ' CD1' HG12 ' A' ' 22' ' ' VAL . 3.7 tp -77.7 -40.9 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 0.0 110.176 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.1 t -50.74 -65.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.907 . . . . 0.0 110.019 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.21 -38.95 71.72 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.5 -0.75 . . . . 0.0 110.07 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -62.17 -46.44 88.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.209 -0.932 . . . . 0.0 109.878 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.482 ' HB2' ' CG ' ' B' ' 38' ' ' PHE . . . -54.33 -33.28 58.58 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 0.0 110.197 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 85.7 t -74.96 -49.97 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.333 -0.855 . . . . 0.0 110.248 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.32 -41.03 96.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.236 -0.915 . . . . 0.0 110.332 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.467 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.2 t80 -61.5 -60.12 4.19 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.918 . . . . 0.0 110.3 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.487 ' CG ' ' HB2' ' B' ' 34' ' ' ALA . 12.5 m-85 -63.62 -47.78 79.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 54.6 m -52.98 -29.88 31.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.948 . . . . 0.0 109.939 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.13 -34.5 37.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.336 -0.852 . . . . 0.0 109.827 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -23.08 63.76 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.322 -0.861 . . . . 0.0 110.068 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -75.36 -26.4 58.5 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.221 -0.924 . . . . 0.0 109.732 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.31 -0.869 . . . . 0.0 110.484 179.79 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -57.45 5.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -1.167 . . . . 0.0 110.235 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.6 m -52.27 -28.6 19.47 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.206 -0.934 . . . . 0.0 110.315 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -71.94 -59.2 2.86 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.184 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -39.16 69.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.261 -0.9 . . . . 0.0 110.289 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.18 -43.96 96.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.239 -0.913 . . . . 0.0 109.997 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -37.88 65.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.216 -0.928 . . . . 0.0 109.65 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.31 -55.35 29.96 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.419 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.6 t80 -48.14 -38.82 18.85 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -1.048 . . . . 0.0 110.363 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -36.32 82.93 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.465 -0.772 . . . . 0.0 110.211 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 90.4 t -80.98 -25.24 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.789 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.7 mt-10 -82.53 -57.14 3.47 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.1 -1.0 . . . . 0.0 109.284 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.427 HG12 ' CD1' ' B' ' 30' ' ' LEU . 22.4 t -55.63 -32.75 31.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 O-C-N 121.708 -0.62 . . . . 0.0 110.101 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.3 -34.38 63.49 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.65 -62.41 1.4 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.25 -0.906 . . . . 0.0 110.346 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.27 -43.22 64.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.311 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.51 62.41 11.12 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.281 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.22 161.51 45.58 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.692 1.364 . . . . 0.0 110.538 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.0 -34.33 10.61 Favored 'Trans proline' 0 C--N 1.31 -1.471 0 O-C-N 123.723 1.38 . . . . 0.0 110.456 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -128.89 124.09 34.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.287 -0.883 . . . . 0.0 110.226 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.427 ' CD1' HG12 ' B' ' 22' ' ' VAL . 3.7 tp -77.8 -41.05 38.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 110.082 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 46.6 t -50.52 -65.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.245 -0.909 . . . . 0.0 110.046 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.17 -38.99 71.67 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.487 -0.758 . . . . 0.0 110.041 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -62.07 -46.5 88.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.898 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.487 ' HB2' ' CG ' ' A' ' 38' ' ' PHE . . . -54.3 -33.44 58.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.437 -0.79 . . . . 0.0 110.217 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.402 ' O ' ' CB ' ' B' ' 39' ' ' THR . 86.7 t -74.87 -49.84 27.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.55 -40.76 95.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.353 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 33.0 t80 -61.65 -60.22 4.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.198 -0.939 . . . . 0.0 110.282 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.482 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 12.5 m-85 -63.48 -47.61 81.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.343 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.402 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 52.9 m -53.13 -29.94 34.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.123 -0.986 . . . . 0.0 109.972 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.1 -34.49 37.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 109.87 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.11 -23.09 63.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.337 -0.852 . . . . 0.0 110.084 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -75.43 -26.47 58.37 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.281 -0.887 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.893 . . . . 0.0 110.499 179.754 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.94 -32.38 72.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -1.172 . . . . 0.0 110.188 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.8 m -69.72 -30.88 68.61 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.158 -0.964 . . . . 0.0 110.228 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -71.48 -54.54 10.26 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.269 -0.894 . . . . 0.0 110.208 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.443 HD23 ' CE1' ' A' ' 38' ' ' PHE . 1.0 OUTLIER -55.59 -53.56 54.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.261 -0.899 . . . . 0.0 110.241 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -53.55 -38.86 64.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.227 -0.921 . . . . 0.0 110.193 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -43.93 70.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.14 -0.975 . . . . 0.0 109.956 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.67 -55.69 27.5 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -49.24 -47.48 46.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.42 -1.047 . . . . 0.0 110.31 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 77.7 m -53.15 -36.18 60.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.393 -0.817 . . . . 0.0 110.316 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.26 -25.0 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.174 -0.954 . . . . 0.0 110.417 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.4 mt-10 -89.13 -60.15 2.03 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.21 -0.931 . . . . 0.0 109.2 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.4 t -53.59 -26.71 13.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.75 -0.594 . . . . 0.0 110.116 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.409 ' CB ' ' O ' ' A' ' 19' ' ' THR . 2.7 tp -85.08 -35.69 21.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.295 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.27 -56.25 3.34 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.362 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.39 -41.94 81.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.158 -0.964 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 52.04 59.07 15.19 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.245 -0.909 . . . . 0.0 110.161 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.26 156.77 58.53 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.675 1.355 . . . . 0.0 110.573 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.45 -27.48 19.05 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.764 1.402 . . . . 0.0 110.453 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.19 119.93 21.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.41 -32.63 28.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.142 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.8 t -53.14 -64.67 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.251 -0.905 . . . . 0.0 109.829 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.91 77.81 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.527 -0.733 . . . . 0.0 109.958 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.55 -48.38 81.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.931 . . . . 0.0 109.521 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.4 -35.06 64.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.873 . . . . 0.0 109.585 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.432 ' CG1' ' OG1' ' B' ' 39' ' ' THR . 55.3 t -81.85 -44.37 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.424 -0.797 . . . . 0.0 109.723 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -26.76 66.96 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.222 -0.924 . . . . 0.0 109.855 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.442 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 38.3 t80 -78.88 -68.02 0.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 110.296 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.443 ' CE1' HD23 ' A' ' 14' ' ' LEU . 17.0 m-85 -52.21 -50.97 60.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.206 -0.934 . . . . 0.0 110.49 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.423 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 90.4 m -50.68 -52.92 35.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.36 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -63.43 -24.07 67.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.05 -29.35 70.23 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 109.997 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -58.14 9.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.332 -0.855 . . . . 0.0 110.174 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.324 -0.86 . . . . 0.0 110.35 -179.915 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.5 tp -67.94 -32.46 72.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -1.149 . . . . 0.0 110.144 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 86.0 m -69.8 -30.68 68.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.304 -0.872 . . . . 0.0 110.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -71.61 -54.4 10.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.44 HD23 ' CE1' ' B' ' 38' ' ' PHE . 1.0 OUTLIER -55.77 -53.51 55.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -53.5 -38.96 64.2 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.32 -0.863 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -44.17 70.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.283 -0.886 . . . . 0.0 109.946 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.37 -55.96 25.83 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -49.0 -47.49 44.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.373 -1.075 . . . . 0.0 110.401 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' THR . . . . . 0.412 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 76.1 m -53.22 -36.14 60.7 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.423 -0.798 . . . . 0.0 110.323 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -78.19 -25.2 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.246 -0.909 . . . . 0.0 110.4 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.455 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.4 mt-10 -88.91 -60.14 2.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.236 -0.915 . . . . 0.0 109.257 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 25.0 t -53.51 -26.78 13.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.676 -0.64 . . . . 0.0 110.149 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . 0.412 ' CB ' ' O ' ' B' ' 19' ' ' THR . 2.7 tp -85.05 -35.73 21.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 -56.32 3.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.893 . . . . 0.0 110.335 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.26 -41.88 80.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.135 -0.978 . . . . 0.0 110.49 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 51.92 59.17 15.22 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.192 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 156.89 57.87 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 O-C-N 123.755 1.397 . . . . 0.0 110.535 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.54 -27.48 18.75 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.676 1.356 . . . . 0.0 110.411 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.2 119.9 21.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.37 -32.84 29.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.886 . . . . 0.0 110.16 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.8 t -52.9 -64.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.264 -0.897 . . . . 0.0 109.865 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.94 77.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.558 -0.714 . . . . 0.0 109.976 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -61.44 -48.52 80.8 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.19 -0.944 . . . . 0.0 109.54 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.32 -35.28 64.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.375 -0.828 . . . . 0.0 109.573 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.423 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 57.1 t -81.66 -44.17 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 O-C-N 121.477 -0.764 . . . . 0.0 109.783 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.27 -26.65 66.67 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.455 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 38.4 t80 -78.98 -67.9 0.71 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.146 -0.971 . . . . 0.0 110.283 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.44 ' CE1' HD23 ' B' ' 14' ' ' LEU . 16.9 m-85 -52.22 -51.01 60.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.239 -0.913 . . . . 0.0 110.426 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.432 ' OG1' ' CG1' ' A' ' 35' ' ' VAL . 84.8 m -50.69 -52.94 35.31 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.38 -24.2 67.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.342 -0.849 . . . . 0.0 109.955 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.91 -29.33 70.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.095 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -58.25 9.3 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.328 -0.857 . . . . 0.0 110.127 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.912 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.342 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.3 tp -77.5 -38.57 48.67 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -1.152 . . . . 0.0 110.37 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.7 m -63.46 -37.93 89.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.205 -0.935 . . . . 0.0 110.383 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.04 -41.76 68.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 110.282 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.56 -44.13 71.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.225 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.83 -51.58 46.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 0.0 110.173 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.42 -34.61 25.11 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.068 -1.02 . . . . 0.0 109.932 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.44 -58.74 12.81 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.425 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.3 t80 -47.54 -44.56 26.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.447 -1.031 . . . . 0.0 110.663 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 m -50.74 -55.72 15.36 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.048 -1.033 . . . . 0.0 108.906 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.79 -44.27 98.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.55 -69.05 0.12 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.426 0.632 . . . . 0.0 110.768 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -52.44 -22.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.389 -0.819 . . . . 0.0 110.519 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.88 -20.99 34.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 110.195 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.77 -56.53 2.26 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.215 -0.928 . . . . 0.0 110.163 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -57.09 -43.58 82.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.26 -0.9 . . . . 0.0 110.148 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.454 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 0.0 OUTLIER 52.57 52.79 11.43 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.372 -0.83 . . . . 0.0 110.162 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 45.1 Cg_endo -71.28 156.18 59.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.633 1.333 . . . . 0.0 110.395 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.33 -29.84 16.4 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.658 1.346 . . . . 0.0 110.167 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.64 119.59 29.45 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.46 -41.93 23.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 0.0 110.346 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -50.7 -59.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.234 -0.916 . . . . 0.0 110.047 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -62.01 -36.02 80.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.508 -0.745 . . . . 0.0 110.024 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.408 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 53.3 t80 -65.49 -44.11 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.287 -0.883 . . . . 0.0 109.706 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.425 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.12 -36.07 70.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.443 -0.786 . . . . 0.0 110.124 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.429 HG23 ' N ' ' B' ' 39' ' ' THR . 98.1 t -78.06 -44.91 27.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.56 -30.29 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.386 -0.821 . . . . 0.0 110.55 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -76.71 -58.26 3.38 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.157 -0.964 . . . . 0.0 110.376 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -65.57 -43.17 90.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.546 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.421 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 53.7 m -54.68 -44.83 73.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.081 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.91 -31.92 72.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.172 -0.955 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -28.19 68.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 109.975 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.405 ' HB3' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -68.6 -30.32 69.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.293 -0.88 . . . . 0.0 110.072 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -77.48 -38.46 49.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.201 -1.176 . . . . 0.0 110.386 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 57.0 m -63.48 -38.1 89.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.11 -0.994 . . . . 0.0 110.331 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.84 -41.79 67.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.257 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.65 -43.99 71.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 110.29 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 92.1 mt -67.87 -51.36 49.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 110.151 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.68 -34.46 26.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.157 -0.964 . . . . 0.0 110.005 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.64 -58.5 13.95 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.414 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.3 t80 -47.76 -44.55 28.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -1.016 . . . . 0.0 110.602 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -50.6 -55.7 15.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.047 -1.033 . . . . 0.0 108.878 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.5 t -63.82 -44.38 98.15 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.407 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER -52.49 -69.01 0.12 Allowed 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.374 0.607 . . . . 0.0 110.734 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.8 t -52.52 -22.73 3.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 O-C-N 121.38 -0.825 . . . . 0.0 110.498 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.8 -21.47 34.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.109 -0.995 . . . . 0.0 110.059 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.28 -56.43 2.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.283 -0.886 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -57.27 -43.68 83.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.158 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.0 OUTLIER 52.84 52.6 10.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.378 -0.826 . . . . 0.0 110.163 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 44.3 Cg_endo -71.05 156.14 60.43 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.639 1.337 . . . . 0.0 110.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.38 -29.63 16.56 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.667 1.351 . . . . 0.0 110.094 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.76 119.43 28.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.365 -0.834 . . . . 0.0 110.109 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.5 -42.03 23.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.239 -0.913 . . . . 0.0 110.254 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -50.66 -59.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.931 . . . . 0.0 110.051 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -62.05 -35.98 80.25 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.59 -0.694 . . . . 0.0 109.971 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 53.2 t80 -65.52 -43.85 88.76 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.309 -0.87 . . . . 0.0 109.656 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.414 ' CA ' ' OH ' ' B' ' 18' ' ' TYR . . . -57.59 -36.07 71.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.372 -0.83 . . . . 0.0 110.097 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' B' ' 39' ' ' THR . 92.4 t -78.02 -44.68 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 O-C-N 121.202 -0.936 . . . . 0.0 110.154 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.69 -30.64 68.92 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.331 -0.856 . . . . 0.0 110.573 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.407 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 74.0 t80 -76.35 -58.32 3.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.129 -0.982 . . . . 0.0 110.367 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.403 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 12.7 m-85 -65.58 -42.52 91.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.597 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.429 ' N ' HG23 ' A' ' 35' ' ' VAL . 53.5 m -55.24 -44.72 75.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.003 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.96 -32.11 72.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.02 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -28.39 68.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.277 -0.89 . . . . 0.0 109.968 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -30.09 68.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.286 -0.884 . . . . 0.0 110.195 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.918 . . . . 0.0 110.086 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -73.76 -28.44 61.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.314 -1.109 . . . . 0.0 110.184 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.5 m -71.64 -43.67 65.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.079 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.9 -36.66 62.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -0.875 . . . . 0.0 110.435 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.83 -50.39 35.98 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.895 . . . . 0.0 110.404 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.68 -49.14 72.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.19 -0.944 . . . . 0.0 110.136 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.97 -34.71 60.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.145 -0.972 . . . . 0.0 109.772 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.96 -52.8 46.6 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 108.705 -1.758 . . . . 0.0 108.705 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.432 ' OH ' ' N ' ' A' ' 34' ' ' ALA . 1.4 t80 -47.67 -37.9 13.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.492 -1.005 . . . . 0.0 110.149 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -65.77 -33.05 74.96 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.585 -0.697 . . . . 0.0 110.335 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.8 t -81.3 -27.28 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 110.687 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -80.79 -56.9 3.82 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.055 -1.028 . . . . 0.0 109.378 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.8 t -56.7 -31.91 36.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.763 -0.585 . . . . 0.0 110.294 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -75.15 -30.76 60.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.236 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.03 -51.71 4.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.205 -0.934 . . . . 0.0 110.484 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.6 -34.49 67.43 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.224 -0.922 . . . . 0.0 109.961 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.97 71.3 1.53 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.267 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.83 169.74 20.48 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.652 1.343 . . . . 0.0 110.462 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.12 -37.98 7.59 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.734 1.386 . . . . 0.0 110.331 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -145.37 148.14 33.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.264 -0.898 . . . . 0.0 110.087 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 mt -83.71 -41.05 18.12 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.244 -0.91 . . . . 0.0 110.176 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -52.13 -63.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.216 -0.928 . . . . 0.0 109.848 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.62 -39.66 85.0 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.539 -0.725 . . . . 0.0 109.882 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.423 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 34.1 t80 -62.83 -51.36 67.35 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 109.783 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.458 ' HB2' ' CD2' ' B' ' 38' ' ' PHE . . . -55.28 -33.88 63.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.387 -0.821 . . . . 0.0 110.004 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.405 ' O ' ' CB ' ' A' ' 39' ' ' THR . 68.9 t -75.4 -50.51 23.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.32 -0.862 . . . . 0.0 110.198 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.46 -28.8 70.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.211 -0.93 . . . . 0.0 110.485 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -77.76 -63.08 1.47 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.219 -0.925 . . . . 0.0 110.471 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 18.6 m-85 -58.6 -43.66 89.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.23 -0.919 . . . . 0.0 110.506 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 65.3 m -57.76 -46.24 84.79 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.335 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.04 -21.62 61.51 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.389 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -77.29 -20.3 55.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.381 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -23.0 43.74 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.227 -0.92 . . . . 0.0 109.758 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.098 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -74.14 -28.39 61.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -1.135 . . . . 0.0 110.136 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.7 m -71.67 -43.69 65.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 110.125 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.83 -36.56 62.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.252 -0.905 . . . . 0.0 110.456 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tp -70.83 -50.44 35.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.175 -0.953 . . . . 0.0 110.336 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.71 -49.14 72.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.95 -34.94 61.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.066 -1.022 . . . . 0.0 109.633 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.67 -53.01 44.5 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.429 ' OH ' ' N ' ' B' ' 34' ' ' ALA . 1.4 t80 -47.61 -37.96 13.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.459 -1.024 . . . . 0.0 110.097 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.3 m -65.75 -32.93 74.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.584 -0.698 . . . . 0.0 110.401 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 55.8 t -81.3 -27.46 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 110.739 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.57 -57.16 3.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.216 -0.927 . . . . 0.0 109.43 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 26.1 t -56.45 -31.84 34.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.76 -0.588 . . . . 0.0 110.305 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 47.7 tp -75.31 -30.57 60.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.221 -0.924 . . . . 0.0 110.334 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.18 -51.65 4.33 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 0.0 110.486 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.71 -34.64 67.25 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.27 -0.894 . . . . 0.0 109.797 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.21 71.15 1.56 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.283 -0.885 . . . . 0.0 110.304 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.79 169.82 20.23 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.591 1.311 . . . . 0.0 110.466 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.18 -37.78 7.71 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.691 1.364 . . . . 0.0 110.315 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -145.61 148.05 32.7 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 110.084 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 mt -83.59 -41.28 18.03 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 41.0 t -51.88 -63.36 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.916 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.68 -39.63 85.15 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.531 -0.731 . . . . 0.0 109.893 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.424 ' CD2' ' CE1' ' B' ' 18' ' ' TYR . 34.2 t80 -62.84 -51.11 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.795 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.431 ' HB2' ' CD2' ' A' ' 38' ' ' PHE . . . -55.53 -33.89 64.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 109.959 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.403 ' O ' ' CB ' ' B' ' 39' ' ' THR . 70.3 t -75.41 -50.42 24.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.252 -0.905 . . . . 0.0 110.124 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.6 -28.78 70.13 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.253 -0.904 . . . . 0.0 110.445 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -77.57 -63.37 1.39 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.224 -0.922 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.458 ' CD2' ' HB2' ' A' ' 34' ' ' ALA . 19.0 m-85 -58.38 -43.83 88.63 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.503 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.403 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 64.5 m -57.55 -46.2 84.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 0.0 110.359 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.14 -21.54 61.44 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.201 -0.937 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -77.52 -20.11 54.75 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.348 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.48 -22.78 43.62 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.225 -0.922 . . . . 0.0 109.763 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.262 -0.899 . . . . 0.0 110.17 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.78 -38.73 92.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.235 -1.156 . . . . 0.0 110.146 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 48.4 m -57.75 -56.38 22.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.55 -50.38 53.57 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.439 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.54 -55.52 28.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.46 -51.78 67.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.92 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.64 -30.41 31.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.003 -1.06 . . . . 0.0 109.648 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.47 -56.81 23.2 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -47.65 -38.17 14.33 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.485 -1.009 . . . . 0.0 110.338 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.1 m -64.63 -34.18 77.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.43 -0.793 . . . . 0.0 109.844 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.34 -27.09 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.364 -0.835 . . . . 0.0 110.358 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.84 -59.25 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.089 -1.007 . . . . 0.0 108.99 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 43.5 t -55.03 -32.01 26.37 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.827 -0.546 . . . . 0.0 110.522 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.73 -22.47 31.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.74 -58.58 2.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.456 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.44 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -82.92 -22.22 33.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.19 -0.944 . . . . 0.0 110.571 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.8 77.42 0.44 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.106 -0.996 . . . . 0.0 110.004 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -70.52 153.78 65.18 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.672 1.354 . . . . 0.0 110.574 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.82 -28.14 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.701 1.369 . . . . 0.0 110.441 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.96 125.28 12.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.347 -0.845 . . . . 0.0 110.15 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.82 -31.38 56.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.292 -0.88 . . . . 0.0 109.989 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.8 t -54.3 -61.17 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 109.859 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.24 -45.69 83.61 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.964 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 25' ' ' GLN . 49.4 t80 -58.15 -47.4 83.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 109.87 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.52 -34.98 52.25 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.373 -0.83 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.421 HG23 ' N ' ' B' ' 39' ' ' THR . 94.0 t -80.85 -52.46 14.17 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 121.19 -0.944 . . . . 0.0 110.14 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.85 -40.31 66.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.314 -0.866 . . . . 0.0 110.554 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -70.38 -68.22 0.44 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.979 . . . . 0.0 110.347 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -50.47 -42.42 54.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.549 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.4 m -58.7 -35.72 73.09 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.103 -0.998 . . . . 0.0 109.855 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.44 -42.22 87.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.292 -0.88 . . . . 0.0 109.952 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 20.1 mt -59.21 -35.55 73.81 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.287 -0.883 . . . . 0.0 109.982 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mmm-85 -56.13 -38.42 70.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.43 -0.794 . . . . 0.0 110.066 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.313 -0.867 . . . . 0.0 110.546 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.84 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -1.134 . . . . 0.0 110.151 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 47.5 m -57.67 -56.7 18.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.299 -0.876 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.3 -50.56 50.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.336 -0.852 . . . . 0.0 110.418 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.59 -55.35 30.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.878 . . . . 0.0 110.311 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.54 -51.81 67.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.269 -0.894 . . . . 0.0 110.264 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.61 -30.57 32.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.112 -0.992 . . . . 0.0 109.654 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.27 -56.77 23.4 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 108.806 -1.717 . . . . 0.0 108.806 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -47.81 -38.04 14.97 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.365 -1.079 . . . . 0.0 110.322 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.77 -33.88 77.03 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.389 -0.819 . . . . 0.0 109.838 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.63 -26.91 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.34 -0.85 . . . . 0.0 110.415 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.0 -59.37 2.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.948 . . . . 0.0 108.897 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 43.8 t -54.91 -32.16 26.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.83 -0.543 . . . . 0.0 110.528 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.51 -22.58 32.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.089 -1.007 . . . . 0.0 110.363 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.61 -58.6 2.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.391 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.431 ' OE1' ' CZ ' ' B' ' 33' ' ' PHE . 0.0 OUTLIER -82.98 -22.29 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.59 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.89 77.44 0.44 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.117 -0.99 . . . . 0.0 109.971 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.66 153.83 64.54 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.717 1.377 . . . . 0.0 110.534 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.85 -28.16 20.34 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 O-C-N 123.838 1.441 . . . . 0.0 110.443 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.98 125.14 12.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.169 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.68 -31.39 57.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.878 . . . . 0.0 110.025 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.9 t -54.22 -61.3 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.303 -0.873 . . . . 0.0 109.789 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -65.21 -45.45 84.66 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.431 ' CZ ' ' OE1' ' B' ' 25' ' ' GLN . 49.4 t80 -58.41 -47.41 84.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.849 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.38 -35.05 50.57 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.361 -0.837 . . . . 0.0 110.23 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 94.8 t -80.79 -52.64 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.64 -40.41 65.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -70.23 -68.41 0.42 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.071 -1.018 . . . . 0.0 110.294 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -50.47 -42.31 54.21 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.421 ' N ' HG23 ' A' ' 35' ' ' VAL . 54.9 m -58.61 -35.86 73.12 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.143 -0.973 . . . . 0.0 109.907 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -42.26 88.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 109.945 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 20.2 mt -59.26 -35.45 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.302 -0.874 . . . . 0.0 109.953 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mmm-85 -56.14 -38.5 70.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.321 -0.862 . . . . 0.0 110.134 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.484 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -75.09 -19.34 60.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -1.168 . . . . 0.0 110.325 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.7 m -69.96 -54.85 11.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.216 -0.928 . . . . 0.0 110.341 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -54.22 -37.12 64.23 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.327 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.5 mt -63.06 -59.35 4.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.197 -0.939 . . . . 0.0 110.289 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.31 -48.81 80.22 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.353 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.32 -38.64 63.38 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.188 -0.945 . . . . 0.0 109.92 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.83 -52.8 48.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.33 -47.74 36.7 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.388 -1.066 . . . . 0.0 110.094 179.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.8 -40.93 56.65 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.387 -0.821 . . . . 0.0 110.471 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -76.97 -25.29 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.219 -0.926 . . . . 0.0 110.822 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.3 -59.08 2.39 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.07 -1.019 . . . . 0.0 109.241 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 44.1 t -52.31 -26.71 9.45 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.3 tp -85.41 -38.13 19.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.093 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -53.52 5.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.205 -0.935 . . . . 0.0 110.082 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -61.64 -41.38 97.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 110.104 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 50.03 56.24 17.45 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.337 -0.852 . . . . 0.0 110.375 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.39 155.81 59.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.623 1.328 . . . . 0.0 110.419 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.5 -21.53 25.88 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 O-C-N 123.706 1.372 . . . . 0.0 110.524 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.67 119.48 15.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.281 -0.887 . . . . 0.0 110.321 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.96 -30.23 35.21 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.337 -0.852 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.2 t -51.51 -66.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.187 -0.946 . . . . 0.0 110.063 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.404 ' OD1' ' NH1' ' B' ' 42' ' ' ARG . 1.1 t70 -55.39 -42.76 74.45 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.363 -0.835 . . . . 0.0 109.971 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -58.31 -50.25 74.3 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.826 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB2' ' CG ' ' B' ' 38' ' ' PHE . . . -53.15 -40.55 64.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.352 -0.843 . . . . 0.0 110.366 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.6 t -74.04 -46.12 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.179 -0.951 . . . . 0.0 110.26 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.44 -24.22 67.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -73.36 -68.13 0.52 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.233 -0.917 . . . . 0.0 110.391 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.446 ' CG ' ' HB2' ' B' ' 34' ' ' ALA . 29.9 m-85 -59.33 -50.78 72.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.944 . . . . 0.0 110.389 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.8 m -49.97 -33.77 18.81 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.12 -0.988 . . . . 0.0 110.235 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -75.39 -25.28 57.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -38.28 90.2 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' NH1' ' OD1' ' B' ' 32' ' ' ASP . 0.0 OUTLIER -50.54 -40.01 50.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 179.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 110.121 179.931 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.388 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -74.97 -19.69 59.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -1.144 . . . . 0.0 110.301 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 74.9 m -69.56 -54.87 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 110.37 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.29 -37.07 64.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.332 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.01 -59.57 4.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.291 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.2 -48.66 80.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 110.283 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -53.36 -38.88 63.71 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.019 -1.05 . . . . 0.0 109.916 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.42 -53.15 45.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 108.86 -1.696 . . . . 0.0 108.86 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.12 -47.68 34.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.405 -1.056 . . . . 0.0 110.146 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.9 -40.82 57.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.518 -0.739 . . . . 0.0 110.513 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -77.14 -25.2 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.185 -0.947 . . . . 0.0 110.676 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.42 -58.86 2.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.105 -0.997 . . . . 0.0 109.265 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 44.4 t -52.51 -26.64 10.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 121.729 -0.607 . . . . 0.0 110.214 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -85.47 -38.17 18.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.26 -0.9 . . . . 0.0 110.056 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.82 -53.53 5.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.177 -0.952 . . . . 0.0 110.023 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -61.6 -41.63 97.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 109.991 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 50.27 56.19 17.29 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.367 -0.833 . . . . 0.0 110.346 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 155.9 58.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 O-C-N 123.713 1.375 . . . . 0.0 110.459 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.46 -21.51 26.01 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.721 1.379 . . . . 0.0 110.6 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.7 119.35 15.02 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.179 -0.951 . . . . 0.0 110.305 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.93 -30.15 35.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.147 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -51.58 -65.99 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . 0.406 ' OD1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 t70 -55.35 -42.94 74.53 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.444 -0.785 . . . . 0.0 109.941 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -58.13 -50.36 73.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.242 -0.911 . . . . 0.0 109.897 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.446 ' HB2' ' CG ' ' A' ' 38' ' ' PHE . . . -53.24 -40.29 64.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.396 -0.815 . . . . 0.0 110.426 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 93.3 t -74.08 -46.23 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.35 -24.27 67.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.172 -0.955 . . . . 0.0 110.294 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -73.29 -67.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.427 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.411 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 29.2 m-85 -59.68 -50.46 73.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.267 -0.895 . . . . 0.0 110.443 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 98.8 m -50.15 -33.83 20.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.074 -1.016 . . . . 0.0 110.205 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -75.27 -25.27 57.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.219 -0.925 . . . . 0.0 109.79 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -38.01 89.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.327 -0.858 . . . . 0.0 109.803 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH1' ' OD1' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -50.88 -39.9 55.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.362 -0.836 . . . . 0.0 110.155 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.35 -0.843 . . . . 0.0 110.234 179.839 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.36 -27.26 61.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.191 -1.182 . . . . 0.0 110.29 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 41.2 m -65.22 -47.29 77.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.238 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -57.63 -33.81 68.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 -58.78 4.27 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 73.4 mt -56.55 -41.58 77.11 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.213 -0.929 . . . . 0.0 109.774 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -41.06 59.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.185 -0.947 . . . . 0.0 109.779 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.61 -61.35 7.58 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.432 ' CE1' ' CE2' ' A' ' 33' ' ' PHE . 2.2 t80 -48.64 -47.73 40.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.459 -1.024 . . . . 0.0 110.506 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.1 -54.41 25.24 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.092 -1.005 . . . . 0.0 108.879 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.29 -44.86 99.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -51.27 -65.07 0.62 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-O 121.478 0.656 . . . . 0.0 110.685 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 t -54.95 -29.29 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.591 -0.693 . . . . 0.0 110.341 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.71 -25.57 61.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.087 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.427 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -104.49 -50.47 3.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.227 -0.921 . . . . 0.0 109.996 179.818 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.419 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -86.34 50.85 2.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.326 -0.859 . . . . 0.0 110.452 -179.893 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.35 96.09 0.11 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.826 -0.546 . . . . 0.0 111.121 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 48.2 Cg_endo -89.92 153.42 4.93 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 124.004 1.529 . . . . 0.0 110.804 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.06 -27.93 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.694 1.365 . . . . 0.0 109.812 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.44 115.8 11.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.488 -0.758 . . . . 0.0 109.839 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.72 -38.26 83.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.261 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.8 t -53.6 -65.72 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.174 -0.954 . . . . 0.0 109.866 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -56.98 -34.73 68.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.359 -0.838 . . . . 0.0 109.964 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.432 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 64.9 t80 -66.75 -44.32 81.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 0.0 109.675 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.43 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -62.55 -30.56 71.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.314 -0.866 . . . . 0.0 109.958 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.8 t -76.55 -48.41 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.337 -0.852 . . . . 0.0 110.165 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.18 -26.3 64.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.477 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -78.25 -68.47 0.64 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.127 -0.983 . . . . 0.0 110.525 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.436 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 20.9 m-85 -56.93 -45.3 82.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.237 -0.915 . . . . 0.0 110.528 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.7 m -53.55 -43.98 68.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.082 -1.011 . . . . 0.0 110.024 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -66.12 -32.08 73.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.323 -0.861 . . . . 0.0 110.116 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -64.9 -40.07 94.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.025 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -39.42 90.16 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.336 -0.852 . . . . 0.0 110.296 -179.947 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.34 -27.28 61.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.229 -1.16 . . . . 0.0 110.299 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 39.9 m -65.22 -47.38 77.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.281 -0.887 . . . . 0.0 110.267 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -57.55 -33.93 68.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.86 -59.04 3.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 110.08 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -56.28 -41.68 76.26 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 109.801 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -40.93 59.74 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.077 -1.014 . . . . 0.0 109.891 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.55 -61.47 7.44 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.44 ' CE1' ' CE2' ' B' ' 33' ' ' PHE . 2.2 t80 -48.63 -47.83 39.93 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.392 -1.064 . . . . 0.0 110.517 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.02 -54.5 24.02 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.147 -0.971 . . . . 0.0 108.886 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.19 -44.71 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.401 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.2 OUTLIER -51.43 -64.98 0.64 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.564 0.697 . . . . 0.0 110.707 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 t -54.99 -29.39 21.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.424 -0.798 . . . . 0.0 110.296 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -25.52 61.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.161 -0.962 . . . . 0.0 110.089 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.421 ' N ' ' HD2' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -104.62 -50.55 3.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.957 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.429 ' O ' ' HD3' ' B' ' 27' ' ' PRO . 0.2 OUTLIER -86.28 50.75 2.05 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.37 -0.831 . . . . 0.0 110.468 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.25 95.98 0.1 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.83 -0.543 . . . . 0.0 111.14 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.429 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 48.3 Cg_endo -89.86 153.48 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 124.014 1.534 . . . . 0.0 110.803 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.04 -28.12 19.58 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.733 1.386 . . . . 0.0 109.88 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.21 115.85 12.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.433 -0.792 . . . . 0.0 109.778 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.66 -38.34 83.64 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.4 t -53.63 -65.6 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -0.959 . . . . 0.0 109.929 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.08 -34.58 68.45 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.507 -0.745 . . . . 0.0 109.983 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.44 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 65.5 t80 -66.98 -43.85 81.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HB2' ' CD2' ' A' ' 38' ' ' PHE . . . -62.89 -30.54 71.61 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.32 -0.862 . . . . 0.0 109.948 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.409 ' O ' ' CB ' ' B' ' 39' ' ' THR . 87.8 t -76.43 -48.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.368 -0.833 . . . . 0.0 110.178 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -59.11 -26.4 64.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 110.473 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -78.12 -68.17 0.66 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.588 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -57.29 -45.43 84.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.206 -0.933 . . . . 0.0 110.426 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.409 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 99.7 m -53.43 -43.85 68.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.099 -1.001 . . . . 0.0 110.079 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -66.23 -31.98 73.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.091 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.03 -39.86 94.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.251 -0.906 . . . . 0.0 110.038 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -39.51 90.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 110.151 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.265 -179.967 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.11 -52.98 19.43 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 110.407 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.1 m -60.76 -49.95 75.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.877 . . . . 0.0 110.401 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.67 -45.57 66.84 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.324 -0.86 . . . . 0.0 110.407 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.08 -53.56 55.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.168 -0.957 . . . . 0.0 110.341 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.7 mt -62.73 -47.82 81.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.21 -0.931 . . . . 0.0 110.08 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.58 -34.55 58.75 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.236 -0.915 . . . . 0.0 109.719 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.77 -55.28 30.85 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -47.39 -43.66 23.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.504 -0.998 . . . . 0.0 110.404 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.4 m -55.9 -36.12 67.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.431 -0.793 . . . . 0.0 110.265 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.7 t -82.41 -25.35 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 110.543 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -85.32 -54.12 4.8 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.13 -0.981 . . . . 0.0 108.886 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.9 t -53.75 -39.15 37.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 CA-C-O 121.219 0.533 . . . . 0.0 110.308 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.99 -40.4 71.88 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -65.42 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.236 -0.915 . . . . 0.0 110.242 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.13 65.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.177 -0.952 . . . . 0.0 110.081 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.96 58.58 16.81 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.318 -0.864 . . . . 0.0 110.566 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.54 146.89 50.63 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.627 1.33 . . . . 0.0 110.303 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.66 -30.77 17.6 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.63 1.332 . . . . 0.0 110.536 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -133.6 121.21 21.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 110.241 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.5 -25.04 41.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.065 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.0 t -54.34 -53.71 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.211 -0.931 . . . . 0.0 109.793 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.38 -47.44 60.9 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.584 -0.697 . . . . 0.0 109.934 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -58.13 -50.51 73.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.224 -0.922 . . . . 0.0 109.577 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.78 -37.35 63.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.306 -0.871 . . . . 0.0 109.921 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 68.8 t -79.31 -34.89 16.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.34 -0.85 . . . . 0.0 109.915 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.76 -22.75 49.76 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -79.76 -64.01 1.28 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.176 -0.952 . . . . 0.0 110.623 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -59.43 -48.07 83.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.198 -0.939 . . . . 0.0 110.533 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.408 ' N ' HG23 ' B' ' 35' ' ' VAL . 62.3 m -52.48 -50.57 62.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.041 -1.037 . . . . 0.0 110.052 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -58.79 -26.7 64.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.157 -0.965 . . . . 0.0 109.832 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -61.63 -40.9 96.5 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.4 -0.813 . . . . 0.0 110.12 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.55 -63.06 1.26 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.907 . . . . 0.0 110.241 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 tp -70.16 -52.81 20.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.093 -1.24 . . . . 0.0 110.422 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 85.7 m -60.86 -49.83 75.88 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.167 -0.958 . . . . 0.0 110.308 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.79 -45.54 67.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.0 110.37 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.1 -53.73 53.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.294 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 66.4 mt -62.63 -47.89 81.77 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.912 . . . . 0.0 110.022 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.55 -34.63 58.92 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.15 -0.969 . . . . 0.0 109.659 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.69 -55.29 30.74 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.85 -1.7 . . . . 0.0 108.85 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -47.43 -43.56 23.95 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.375 -1.074 . . . . 0.0 110.336 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.4 m -56.09 -35.92 67.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.531 -0.731 . . . . 0.0 110.254 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.46 -25.53 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.26 -0.9 . . . . 0.0 110.476 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -85.22 -54.06 4.85 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 108.877 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 95.6 t -53.82 -39.04 37.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.859 -0.526 . . . . 0.0 110.249 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 12.2 mt -71.1 -40.53 71.45 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.235 -0.915 . . . . 0.0 110.146 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.04 -65.48 0.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 110.266 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.26 -31.09 65.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.203 -0.936 . . . . 0.0 110.015 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.93 58.56 16.83 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.525 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.37 146.96 51.73 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.691 1.364 . . . . 0.0 110.339 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.71 -31.01 17.04 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.685 1.361 . . . . 0.0 110.52 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -133.43 121.34 22.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.274 -0.891 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.52 -25.16 41.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 110.067 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 41.6 t -54.22 -53.73 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.768 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.42 -47.37 61.05 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.598 -0.689 . . . . 0.0 109.952 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -58.2 -50.33 73.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 109.619 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.87 -37.51 63.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.345 -0.847 . . . . 0.0 109.881 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.408 HG23 ' N ' ' A' ' 39' ' ' THR . 72.2 t -79.13 -34.78 16.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 O-C-N 121.341 -0.85 . . . . 0.0 110.019 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.94 -22.64 49.23 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.314 -0.866 . . . . 0.0 109.669 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -79.75 -64.24 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.218 -0.926 . . . . 0.0 110.586 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -59.21 -47.98 83.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.184 -0.947 . . . . 0.0 110.683 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 61.0 m -52.76 -50.37 63.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.956 -1.09 . . . . 0.0 110.051 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -59.0 -26.65 64.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.857 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -61.67 -40.87 96.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 110.04 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.45 -63.21 1.22 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.283 -0.886 . . . . 0.0 110.193 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.16 -29.16 70.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 110.214 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.9 m -56.77 -45.73 81.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.9 . . . . 0.0 110.123 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 -36.92 79.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -0.846 . . . . 0.0 110.366 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.33 -47.9 53.72 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.2 -0.938 . . . . 0.0 110.232 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -58.2 6.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.075 -1.015 . . . . 0.0 110.102 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.4 -24.69 5.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.155 -0.966 . . . . 0.0 109.903 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.94 -57.41 10.89 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.417 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.1 t80 -48.54 -35.8 14.07 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.384 -1.068 . . . . 0.0 110.312 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.01 -39.17 93.96 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.42 -0.8 . . . . 0.0 110.065 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.423 ' O ' ' CB ' ' A' ' 24' ' ' ARG . 92.2 t -80.88 -21.52 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 110.798 -179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.95 -55.05 4.01 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.065 -1.022 . . . . 0.0 109.333 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.0 t -56.85 -31.18 35.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.722 -0.611 . . . . 0.0 110.389 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 mt -87.43 -42.0 13.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.218 -0.926 . . . . 0.0 110.34 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -71.9 -53.27 13.69 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.143 -0.973 . . . . 0.0 110.262 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.31 -35.35 63.66 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.191 -0.943 . . . . 0.0 109.855 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.3 64.07 8.97 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.476 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.39 151.29 65.38 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.741 1.39 . . . . 0.0 110.527 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.36 -22.52 25.05 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.733 1.386 . . . . 0.0 110.272 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.73 116.31 14.75 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.261 -0.9 . . . . 0.0 110.13 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.5 tp -80.53 -34.2 35.73 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 110.307 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.4 t -51.67 -66.21 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.208 -0.932 . . . . 0.0 110.142 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.15 -40.5 67.49 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.428 -0.795 . . . . 0.0 109.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.9 -54.98 38.44 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.36 -0.838 . . . . 0.0 109.763 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.417 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -53.0 -38.55 62.4 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.429 HG21 ' N ' ' B' ' 39' ' ' THR . 81.6 t -77.37 -27.09 15.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.293 -0.879 . . . . 0.0 109.837 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.99 -51.94 7.54 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.334 -0.854 . . . . 0.0 109.868 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -56.71 -63.17 1.29 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 110.786 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -53.89 -52.31 60.93 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 111.008 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.441 ' N ' HG21 ' B' ' 35' ' ' VAL . 22.3 m -53.36 -24.93 13.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.933 -1.104 . . . . 0.0 110.086 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -25.56 43.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.929 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.6 -25.35 60.29 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.04 -29.1 64.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.262 -0.899 . . . . 0.0 109.629 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.32 -0.862 . . . . 0.0 110.184 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.1 -29.32 70.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -1.148 . . . . 0.0 110.212 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 93.9 m -56.66 -45.68 81.5 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.249 -0.907 . . . . 0.0 110.239 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -36.79 79.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.364 -0.835 . . . . 0.0 110.281 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.53 -47.79 52.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.273 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.27 -58.2 6.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 110.214 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.52 -24.65 5.45 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.21 -0.931 . . . . 0.0 109.858 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.81 -57.61 10.67 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.427 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.1 t80 -48.44 -35.85 13.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.423 -1.045 . . . . 0.0 110.394 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.02 -39.19 94.02 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.479 -0.763 . . . . 0.0 110.039 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' B' ' 24' ' ' ARG . 92.9 t -80.76 -21.57 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.952 . . . . 0.0 110.825 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.97 -55.14 3.96 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.014 -1.053 . . . . 0.0 109.269 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 29.1 t -56.79 -31.07 34.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.716 -0.615 . . . . 0.0 110.475 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.51 -42.14 12.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.0 110.29 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.419 ' CB ' ' O ' ' B' ' 20' ' ' VAL . 0.2 OUTLIER -71.88 -53.2 13.93 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 110.241 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.29 -35.4 63.72 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.202 -0.936 . . . . 0.0 109.763 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.28 64.14 8.86 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.323 -0.861 . . . . 0.0 110.441 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.56 151.32 64.42 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.675 1.355 . . . . 0.0 110.449 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.41 -22.36 25.08 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.714 1.376 . . . . 0.0 110.313 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.81 116.4 14.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 110.067 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 tp -80.67 -34.32 34.89 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.365 -0.835 . . . . 0.0 110.261 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.5 t -51.59 -66.33 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.271 -0.893 . . . . 0.0 110.038 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.03 -40.57 67.19 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.543 -0.723 . . . . 0.0 109.831 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -60.79 -55.09 37.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.409 -0.807 . . . . 0.0 109.688 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.427 ' CA ' ' OH ' ' B' ' 18' ' ' TYR . . . -52.96 -38.25 61.89 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.395 -0.816 . . . . 0.0 109.997 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.441 HG21 ' N ' ' A' ' 39' ' ' THR . 81.1 t -77.73 -26.76 15.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 O-C-N 121.248 -0.907 . . . . 0.0 109.838 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -82.3 -51.96 7.39 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.275 -0.891 . . . . 0.0 109.772 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -56.85 -63.01 1.35 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 0.0 110.715 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -54.15 -52.1 62.2 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.926 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.429 ' N ' HG21 ' A' ' 35' ' ' VAL . 22.4 m -53.37 -25.2 14.49 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.08 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -25.91 43.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 109.84 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.14 -25.41 60.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.242 -0.911 . . . . 0.0 110.03 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -28.99 64.73 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.371 -0.83 . . . . 0.0 109.672 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.199 -179.948 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.54 -27.1 60.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.257 -1.143 . . . . 0.0 110.239 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.09 -61.64 2.31 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.57 -48.37 57.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 0.0 110.371 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.68 -57.91 10.01 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.291 -0.88 . . . . 0.0 110.153 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -60.69 -38.55 85.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -42.85 69.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.091 -1.005 . . . . 0.0 109.754 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.417 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -56.49 -56.23 25.58 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.844 -1.702 . . . . 0.0 108.844 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.422 ' OH ' ' CB ' ' A' ' 34' ' ' ALA . 1.4 t80 -47.09 -45.86 22.31 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.467 -1.019 . . . . 0.0 110.423 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -61.22 -32.89 72.67 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -0.767 . . . . 0.0 109.86 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.0 t -82.72 -26.99 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.871 . . . . 0.0 110.664 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -80.12 -59.21 2.8 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.089 -1.007 . . . . 0.0 109.016 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 26' ' ' GLN . 20.7 t -54.93 -32.94 27.51 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.883 -0.511 . . . . 0.0 109.8 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.26 -19.86 42.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.082 -1.011 . . . . 0.0 110.215 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.15 -49.45 8.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -0.921 . . . . 0.0 110.504 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.431 ' CG ' ' HD3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -99.99 -23.59 14.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.22 -0.925 . . . . 0.0 110.678 -179.693 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.4 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.4 mt-30 49.67 71.04 1.7 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.431 ' HD3' ' CG ' ' A' ' 25' ' ' GLN . 44.6 Cg_endo -71.2 154.09 61.96 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.679 1.357 . . . . 0.0 110.379 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.02 -42.14 3.37 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.358 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -110.16 114.64 28.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.26 -0.9 . . . . 0.0 110.152 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.17 -33.75 22.23 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.866 . . . . 0.0 109.93 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.9 t -52.9 -64.79 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 0.0 109.799 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.532 -0.73 . . . . 0.0 109.828 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -53.96 -47.1 71.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.842 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.452 ' HB2' ' CG ' ' B' ' 38' ' ' PHE . . . -52.34 -46.94 66.3 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.316 -0.865 . . . . 0.0 109.945 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' A' ' 39' ' ' THR . 94.8 t -62.76 -49.12 84.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 O-C-N 121.206 -0.934 . . . . 0.0 109.871 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.42 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -51.28 -56.48 12.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.383 -0.823 . . . . 0.0 110.531 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -53.35 -63.81 1.03 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.424 ' CG ' ' HB2' ' B' ' 34' ' ' ALA . 22.8 m-85 -58.29 -53.45 58.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 110.479 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 90.3 m -51.52 -33.66 32.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.138 -0.976 . . . . 0.0 110.164 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.87 -29.83 44.7 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.0 109.979 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.62 -34.79 69.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 110.086 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -31.5 69.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.262 -0.899 . . . . 0.0 110.162 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.206 -0.934 . . . . 0.0 110.204 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.59 -27.08 60.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -1.149 . . . . 0.0 110.19 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.04 -61.88 2.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.226 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.34 -48.32 55.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.824 . . . . 0.0 110.454 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.72 -58.02 9.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.55 -38.44 84.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.307 -0.871 . . . . 0.0 110.314 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.24 -42.81 70.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.059 -1.025 . . . . 0.0 109.76 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . 0.418 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -56.6 -56.16 26.06 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.417 ' OH ' ' CB ' ' B' ' 34' ' ' ALA . 1.4 t80 -47.16 -45.79 23.04 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.519 -0.989 . . . . 0.0 110.4 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -61.33 -32.66 72.54 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.52 -0.737 . . . . 0.0 109.963 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 48.2 t -82.78 -27.1 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 110.599 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' B' ' 17' ' ' GLY . 1.0 OUTLIER -80.06 -59.24 2.79 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.133 -0.979 . . . . 0.0 109.083 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 20.5 t -54.97 -32.71 27.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.801 -0.562 . . . . 0.0 109.857 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.51 -19.79 41.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 0.0 110.134 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -49.48 8.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.252 -0.905 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.431 ' CG ' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -99.98 -23.69 14.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.24 -0.912 . . . . 0.0 110.671 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 49.75 70.97 1.73 Allowed Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.079 -1.013 . . . . 0.0 110.519 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.431 ' HD3' ' CG ' ' B' ' 25' ' ' GLN . 44.4 Cg_endo -71.16 153.93 62.21 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.689 1.363 . . . . 0.0 110.364 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.99 -42.02 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 123.672 1.354 . . . . 0.0 110.299 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -110.36 114.5 28.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.908 . . . . 0.0 110.13 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.99 -33.84 22.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.229 -0.919 . . . . 0.0 109.969 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.0 t -52.82 -64.76 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.327 -0.858 . . . . 0.0 109.837 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.87 -45.86 82.22 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -54.13 -47.2 72.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.245 -0.909 . . . . 0.0 109.807 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.424 ' HB2' ' CG ' ' A' ' 38' ' ' PHE . . . -52.26 -46.83 65.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 0.0 109.969 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' B' ' 39' ' ' THR . 99.3 t -62.96 -49.0 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.278 -0.889 . . . . 0.0 109.873 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.423 ' N ' ' OE1' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -51.32 -56.47 12.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.477 -0.764 . . . . 0.0 110.519 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -53.25 -64.18 0.9 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.0 110.424 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.452 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 23.1 m-85 -58.01 -53.28 60.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.205 -0.935 . . . . 0.0 110.534 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.419 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 89.5 m -51.69 -33.63 34.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.075 -1.016 . . . . 0.0 110.113 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -29.88 44.35 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.273 -0.892 . . . . 0.0 110.024 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.45 -35.06 69.65 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.856 . . . . 0.0 110.071 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.73 -31.63 69.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.264 -0.897 . . . . 0.0 110.14 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.252 -179.891 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -32.47 49.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -1.126 . . . . 0.0 110.371 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -59.47 -56.09 26.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.95 . . . . 0.0 110.261 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -51.93 -30.08 22.95 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.366 -0.834 . . . . 0.0 110.383 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.6 tp -69.85 -56.94 5.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.155 -0.966 . . . . 0.0 110.174 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.84 -46.06 89.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.163 -0.961 . . . . 0.0 110.191 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.76 -33.86 50.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.257 -0.902 . . . . 0.0 109.881 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.16 -57.63 17.53 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.422 ' OH ' ' N ' ' A' ' 34' ' ' ALA . 2.1 t80 -45.13 -35.89 3.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.897 . . . . 0.0 110.711 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 31.9 m -67.98 -35.1 77.79 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.825 . . . . 0.0 109.952 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.43 -24.38 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.218 -0.926 . . . . 0.0 110.4 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -76.9 -56.71 4.36 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.07 -1.019 . . . . 0.0 108.679 179.501 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.0 t -56.35 -35.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 121.188 0.518 . . . . 0.0 110.245 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.426 ' N ' HD21 ' A' ' 23' ' ' LEU . 3.8 mm? -73.73 -23.11 59.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.255 -0.903 . . . . 0.0 110.377 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.17 -65.39 1.02 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.249 -0.907 . . . . 0.0 110.764 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.79 -29.11 55.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.162 -0.961 . . . . 0.0 110.574 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 53.08 76.81 0.49 Allowed Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 0.0 110.055 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.97 156.69 55.93 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.727 1.382 . . . . 0.0 110.558 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.17 -33.5 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.769 1.405 . . . . 0.0 110.404 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -127.86 116.03 19.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.349 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' B' ' 14' ' ' LEU . 11.4 tp -74.35 -44.68 51.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.328 -0.858 . . . . 0.0 110.059 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.1 t -50.61 -60.85 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.367 -0.833 . . . . 0.0 109.896 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.86 -37.92 77.59 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.629 -0.669 . . . . 0.0 109.945 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 27.8 t80 -62.57 -51.61 66.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.28 -0.888 . . . . 0.0 109.699 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.422 ' N ' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -36.76 56.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.422 HG23 ' N ' ' B' ' 39' ' ' THR . 97.7 t -73.94 -51.55 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 O-C-N 121.207 -0.933 . . . . 0.0 110.173 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.24 -29.82 69.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.195 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.428 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 74.5 t80 -78.24 -67.39 0.74 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.283 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -51.69 -44.53 63.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.275 -0.89 . . . . 0.0 110.309 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.4 m -54.62 -44.56 73.24 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.724 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -71.49 -27.15 63.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.332 -0.855 . . . . 0.0 109.814 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.856 . . . . 0.0 110.027 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.67 -26.71 60.03 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.284 -0.885 . . . . 0.0 109.848 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 110.485 179.82 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.45 -32.48 48.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.201 -1.176 . . . . 0.0 110.41 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.2 m -59.4 -56.17 25.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.167 -0.958 . . . . 0.0 110.327 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.9 -29.86 21.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.321 -0.862 . . . . 0.0 110.463 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.408 ' CD2' HD22 ' A' ' 30' ' ' LEU . 17.5 tp -70.11 -56.79 5.99 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.98 -45.93 90.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.936 . . . . 0.0 110.187 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.79 -34.08 51.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.312 -0.867 . . . . 0.0 109.846 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.25 -57.53 17.9 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.416 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 2.1 t80 -45.01 -36.12 3.28 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.566 -0.961 . . . . 0.0 110.623 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 33.6 m -67.77 -35.14 78.16 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.437 -0.789 . . . . 0.0 110.04 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.45 -24.39 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.236 -0.915 . . . . 0.0 110.399 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.445 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -76.89 -56.65 4.4 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.184 -0.948 . . . . 0.0 108.698 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 46.3 t -56.29 -36.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 121.206 0.526 . . . . 0.0 110.188 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . 0.416 HD21 ' N ' ' B' ' 23' ' ' LEU . 3.8 mm? -73.51 -23.0 59.97 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.32 -65.36 1.02 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.211 -0.931 . . . . 0.0 110.71 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.89 -28.94 55.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.175 -0.953 . . . . 0.0 110.659 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 52.98 76.95 0.48 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.109 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.11 156.68 55.39 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.765 1.403 . . . . 0.0 110.637 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.12 -33.37 11.74 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.779 1.41 . . . . 0.0 110.448 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -128.12 116.12 19.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 110.259 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 tp -74.47 -44.66 50.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.217 -0.927 . . . . 0.0 110.023 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.9 t -50.74 -60.88 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.242 -0.911 . . . . 0.0 109.859 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.61 -37.9 76.84 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.584 -0.698 . . . . 0.0 109.853 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.41 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 27.9 t80 -62.87 -51.35 67.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.304 -0.872 . . . . 0.0 109.654 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.416 ' CA ' ' OH ' ' B' ' 18' ' ' TYR . . . -52.84 -36.5 58.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.001 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 95.6 t -74.18 -51.55 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.262 -0.898 . . . . 0.0 110.059 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.31 -29.39 68.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.253 -0.904 . . . . 0.0 110.377 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.445 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 74.4 t80 -78.53 -67.27 0.76 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.186 -0.946 . . . . 0.0 110.261 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -51.8 -44.54 63.52 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.422 ' N ' HG23 ' A' ' 35' ' ' VAL . 47.1 m -54.5 -44.53 72.79 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.161 -0.962 . . . . 0.0 109.717 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -71.84 -26.81 62.52 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 109.83 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -63.09 -25.26 68.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 110.037 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.84 -26.68 59.87 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 109.744 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 110.448 179.832 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.7 tt -75.04 -32.33 61.53 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -1.102 . . . . 0.0 110.094 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.2 m -62.67 -49.47 75.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.0 110.126 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -54.75 -49.96 69.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 110.257 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.85 -50.0 70.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.353 -0.842 . . . . 0.0 110.327 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -56.1 -52.44 64.29 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 110.177 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.28 -33.71 43.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.127 -0.983 . . . . 0.0 109.804 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.88 -55.45 30.49 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 108.803 -1.719 . . . . 0.0 108.803 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.431 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.0 OUTLIER -49.78 -45.43 49.72 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.366 -1.079 . . . . 0.0 110.396 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 85.3 m -59.08 -35.77 73.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.401 -0.812 . . . . 0.0 110.069 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.4 t -76.66 -27.06 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.484 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -85.23 -64.22 1.19 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.2 -0.937 . . . . 0.0 109.338 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.435 HG21 ' CE2' ' A' ' 33' ' ' PHE . 39.3 t -50.55 -25.76 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.752 -0.592 . . . . 0.0 110.451 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 19' ' ' THR . 19.6 tp -88.36 -25.64 22.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.244 -0.91 . . . . 0.0 110.205 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.64 -56.38 3.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.159 -0.963 . . . . 0.0 110.529 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.452 ' HG3' ' N ' ' A' ' 26' ' ' GLN . 5.9 pt20 -85.32 -27.03 26.19 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.075 -1.016 . . . . 0.0 110.581 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.452 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.3 OUTLIER 47.87 80.68 0.28 Allowed Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 0.0 110.632 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.74 161.66 44.46 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.622 1.327 . . . . 0.0 110.547 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.3 -36.02 7.64 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.736 1.387 . . . . 0.0 110.236 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -130.08 113.8 14.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.308 -0.87 . . . . 0.0 110.001 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.3 tp -67.2 -36.56 81.99 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.0 110.367 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.0 t -51.3 -65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.216 -0.927 . . . . 0.0 110.091 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.409 ' HA ' ' NH1' ' B' ' 42' ' ' ARG . 1.0 OUTLIER -54.24 -40.87 68.14 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.527 -0.733 . . . . 0.0 109.997 179.711 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.435 ' CE2' HG21 ' A' ' 22' ' ' VAL . 66.6 t80 -60.5 -46.71 89.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.771 179.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.431 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.78 -44.44 86.23 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.145 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.0 t -69.91 -34.49 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.301 -0.874 . . . . 0.0 110.021 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.5 40.12 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.279 -0.888 . . . . 0.0 109.751 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 16.1 t80 -76.58 -68.48 0.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.158 -0.964 . . . . 0.0 110.291 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -51.67 -50.31 60.67 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.224 -0.922 . . . . 0.0 110.575 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.8 m -53.14 -39.07 63.24 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.949 -1.094 . . . . 0.0 110.054 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -73.01 -27.21 61.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.33 -0.856 . . . . 0.0 109.989 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.76 -35.47 76.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.358 -0.839 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.1 -38.2 70.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.268 -0.895 . . . . 0.0 110.222 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.223 -0.923 . . . . 0.0 110.576 -179.926 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tt -75.06 -32.32 61.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.326 -1.102 . . . . 0.0 110.113 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.8 m -62.58 -49.5 75.0 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.344 -0.848 . . . . 0.0 110.15 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -54.73 -49.97 69.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.848 . . . . 0.0 110.267 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.84 -50.13 70.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.264 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -56.02 -52.61 63.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -33.99 40.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.11 -0.994 . . . . 0.0 109.856 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.61 -55.6 29.59 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.88 -1.688 . . . . 0.0 108.88 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.429 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.0 OUTLIER -49.7 -45.53 49.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.417 -1.049 . . . . 0.0 110.395 179.535 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 84.8 m -58.94 -35.63 73.43 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.418 -0.801 . . . . 0.0 110.072 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 83.9 t -76.92 -26.92 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.274 -0.891 . . . . 0.0 110.417 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.444 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -85.29 -64.21 1.19 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.109 -0.995 . . . . 0.0 109.357 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.439 HG21 ' CE2' ' B' ' 33' ' ' PHE . 39.2 t -50.57 -25.68 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.716 -0.615 . . . . 0.0 110.329 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . 0.414 ' CB ' ' O ' ' B' ' 19' ' ' THR . 19.9 tp -88.57 -25.53 22.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.118 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.83 -56.32 3.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.167 -0.958 . . . . 0.0 110.494 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 6.0 pt20 -85.36 -26.94 26.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.153 -0.967 . . . . 0.0 110.596 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.435 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 0.3 OUTLIER 47.86 80.65 0.28 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.177 -0.952 . . . . 0.0 110.524 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.402 ' HD3' ' HG3' ' B' ' 25' ' ' GLN . 45.7 Cg_endo -71.65 161.54 44.94 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.791 1.416 . . . . 0.0 110.567 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -36.09 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.67 1.353 . . . . 0.0 110.212 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -129.86 113.88 15.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -0.894 . . . . 0.0 110.001 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.3 tp -67.21 -36.51 81.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 110.374 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.8 t -51.34 -65.4 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.255 -0.903 . . . . 0.0 110.09 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.52 -40.57 68.73 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.437 -0.79 . . . . 0.0 109.923 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.439 ' CE2' HG21 ' B' ' 22' ' ' VAL . 66.4 t80 -60.55 -47.0 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.22 -0.925 . . . . 0.0 109.755 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.429 ' CA ' ' OH ' ' B' ' 18' ' ' TYR . . . -57.36 -44.46 84.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.264 -0.898 . . . . 0.0 110.252 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 98.1 t -70.06 -34.48 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.204 -0.935 . . . . 0.0 109.987 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.58 40.14 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.359 -0.838 . . . . 0.0 109.748 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.444 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 16.2 t80 -76.42 -68.44 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.981 . . . . 0.0 110.383 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -51.84 -50.2 61.36 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 51.8 m -53.21 -38.99 63.38 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.082 -1.011 . . . . 0.0 110.047 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -73.08 -27.24 61.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.946 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -35.5 76.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.339 -0.851 . . . . 0.0 110.11 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.409 ' NH1' ' HA ' ' A' ' 32' ' ' ASP . 3.4 mtp180 -56.07 -38.34 70.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.174 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.64 -179.897 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.34 -19.74 29.34 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 0.0 110.312 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.3 m -77.04 -45.64 26.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.237 -0.914 . . . . 0.0 110.286 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -55.05 -57.35 12.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.304 -0.872 . . . . 0.0 110.121 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.03 -54.03 41.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 110.238 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.867 . . . . 0.0 110.244 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.26 -40.03 73.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.145 -0.972 . . . . 0.0 109.787 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.55 -53.65 39.91 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.422 ' OH ' ' CB ' ' A' ' 34' ' ' ALA . 1.4 t80 -48.49 -48.72 37.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.426 -1.044 . . . . 0.0 110.209 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 51.8 m -54.5 -32.5 58.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.474 -0.766 . . . . 0.0 110.221 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.19 -24.62 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.229 -0.919 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.48 ' OE2' ' CE1' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -88.65 -58.55 2.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.438 HG21 ' CE2' ' A' ' 33' ' ' PHE . 50.4 t -50.59 -41.12 20.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.735 -0.603 . . . . 0.0 110.364 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.2 -34.76 59.29 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.133 -0.98 . . . . 0.0 110.186 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.34 -49.45 14.93 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 110.324 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.09 -37.06 58.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.211 -0.93 . . . . 0.0 110.351 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.431 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 2.1 mt-30 53.21 53.95 12.18 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.237 -0.914 . . . . 0.0 110.285 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 43.5 Cg_endo -70.2 157.13 60.48 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.672 1.354 . . . . 0.0 110.48 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.0 -32.91 10.44 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.653 1.344 . . . . 0.0 110.411 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -120.14 122.75 41.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.229 -0.919 . . . . 0.0 110.281 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 tp -85.69 -36.83 20.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.21 -0.931 . . . . 0.0 110.114 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -51.47 -57.78 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.21 -0.931 . . . . 0.0 109.903 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -62.36 -37.38 85.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.643 -0.661 . . . . 0.0 110.087 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.438 ' CE2' HG21 ' A' ' 22' ' ' VAL . 74.7 t80 -65.39 -43.17 91.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.274 -0.891 . . . . 0.0 109.783 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.422 ' CB ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.59 -37.93 74.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.404 -0.81 . . . . 0.0 110.062 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.443 HG23 ' N ' ' B' ' 39' ' ' THR . 89.2 t -69.71 -50.34 50.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 O-C-N 121.21 -0.931 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.76 -26.09 65.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.505 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.48 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 12.4 t80 -75.82 -68.69 0.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.125 -0.984 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -57.81 -47.97 81.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 110.625 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 35' ' ' VAL . 64.6 m -51.27 -45.52 62.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.12 -0.987 . . . . 0.0 110.023 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -74.0 -26.49 60.47 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.299 -0.875 . . . . 0.0 109.628 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -53.31 -36.55 61.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.932 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -42.15 92.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.319 -0.863 . . . . 0.0 110.113 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.293 -0.879 . . . . 0.0 110.452 -179.886 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.36 -19.62 29.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -1.136 . . . . 0.0 110.308 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 66.5 m -77.14 -45.66 26.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.239 -0.913 . . . . 0.0 110.269 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -54.98 -57.41 11.79 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.147 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.07 -53.98 42.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.333 -0.855 . . . . 0.0 110.245 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.35 -40.67 74.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -39.76 72.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.116 -0.99 . . . . 0.0 109.922 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.91 -53.47 41.91 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 108.807 -1.717 . . . . 0.0 108.807 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.419 ' OH ' ' CB ' ' B' ' 34' ' ' ALA . 1.5 t80 -48.7 -48.46 40.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.429 -1.042 . . . . 0.0 110.263 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.2 m -54.58 -32.43 58.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.469 -0.769 . . . . 0.0 110.185 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 96.2 t -81.25 -24.85 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 110.54 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.471 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.8 OUTLIER -88.44 -58.47 2.54 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.181 -0.949 . . . . 0.0 109.296 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.427 HG21 ' CE2' ' B' ' 33' ' ' PHE . 49.8 t -50.67 -40.96 20.11 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.765 -0.584 . . . . 0.0 110.414 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.3 -34.9 59.05 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.175 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.29 -49.35 15.2 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.141 -0.975 . . . . 0.0 110.339 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -76.23 -36.96 58.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.425 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 2.1 mt-30 53.15 53.97 12.29 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.352 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.7 Cg_endo -70.22 157.04 60.75 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.735 1.387 . . . . 0.0 110.503 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.76 -33.1 10.71 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.729 1.384 . . . . 0.0 110.498 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -120.08 123.03 42.39 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.18 -0.95 . . . . 0.0 110.365 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -85.81 -37.12 19.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.074 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 46.0 t -51.04 -57.93 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.261 -0.9 . . . . 0.0 110.004 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -62.31 -37.43 85.53 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.527 -0.733 . . . . 0.0 110.17 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.427 ' CE2' HG21 ' B' ' 22' ' ' VAL . 74.4 t80 -65.17 -43.45 91.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.854 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.419 ' CB ' ' OH ' ' B' ' 18' ' ' TYR . . . -57.38 -38.15 73.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.306 -0.871 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 99.9 t -69.54 -50.18 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 O-C-N 121.271 -0.893 . . . . 0.0 110.183 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.92 -26.12 65.68 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.298 -0.876 . . . . 0.0 110.512 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.471 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 12.2 t80 -75.91 -68.66 0.55 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.409 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 45.7 m-85 -57.81 -47.71 81.83 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.909 . . . . 0.0 110.534 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.443 ' N ' HG23 ' A' ' 35' ' ' VAL . 68.9 m -51.47 -45.64 62.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.022 -1.049 . . . . 0.0 109.963 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -73.74 -26.78 60.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 109.688 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -53.29 -36.55 61.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 109.91 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.48 93.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 110.036 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.401 -0.812 . . . . 0.0 110.529 -179.884 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -26.08 30.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.224 -1.163 . . . . 0.0 110.303 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -53.47 -56.4 17.27 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.219 -0.926 . . . . 0.0 110.323 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.46 -50.14 63.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.401 -0.812 . . . . 0.0 110.408 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mp -52.83 -53.49 47.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.342 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 15' ' ' LEU . 4.6 mm? -65.37 -51.89 57.39 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 110.434 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.5 -33.05 43.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.062 -1.024 . . . . 0.0 109.897 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.23 -55.85 28.48 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 108.913 -1.675 . . . . 0.0 108.913 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.484 ' CE2' HD13 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -48.2 -44.78 33.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.407 -1.055 . . . . 0.0 110.391 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -55.63 -37.32 68.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.416 -0.802 . . . . 0.0 110.204 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.6 t -80.56 -25.64 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.671 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -85.67 -58.48 2.64 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.001 -1.062 . . . . 0.0 109.083 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 38.9 t -52.03 -34.09 17.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.757 -0.589 . . . . 0.0 110.179 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.5 -33.9 54.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.07 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.54 -66.28 0.91 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.263 -0.898 . . . . 0.0 110.12 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.71 -40.89 66.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.068 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.49 56.61 13.75 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.307 -0.871 . . . . 0.0 110.364 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.51 151.32 58.85 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.66 1.347 . . . . 0.0 110.295 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.78 -28.39 20.43 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.701 1.369 . . . . 0.0 110.26 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.65 120.05 30.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.315 -0.866 . . . . 0.0 110.086 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.484 HD13 ' CE2' ' A' ' 18' ' ' TYR . 9.4 tp -82.88 -36.63 25.2 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 110.287 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.8 t -51.02 -63.58 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.186 -0.946 . . . . 0.0 110.112 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.48 -35.76 72.69 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.455 -0.778 . . . . 0.0 110.103 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -66.58 -43.18 85.61 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 109.909 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.77 -35.29 74.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.389 -0.819 . . . . 0.0 110.275 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.4 t -74.24 -45.56 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 121.224 -0.923 . . . . 0.0 110.341 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.47 -20.64 66.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.25 -0.906 . . . . 0.0 110.373 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.51 -71.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.19 -0.944 . . . . 0.0 110.353 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -56.48 -47.21 79.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.203 -0.936 . . . . 0.0 110.447 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.3 m -51.82 -42.85 62.82 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -75.15 -23.45 57.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.194 -0.941 . . . . 0.0 110.03 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -32.73 74.39 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.291 -0.88 . . . . 0.0 110.033 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -29.4 34.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.304 -0.872 . . . . 0.0 110.017 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.418 -0.802 . . . . 0.0 110.1 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -26.01 31.06 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.281 -1.129 . . . . 0.0 110.263 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 38.9 m -53.64 -56.25 18.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.278 -0.889 . . . . 0.0 110.309 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.58 -50.19 63.48 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.361 -0.837 . . . . 0.0 110.365 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.75 -53.57 46.14 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.388 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.412 ' N ' HD23 ' B' ' 15' ' ' LEU . 4.6 mm? -65.27 -51.9 57.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.216 -0.928 . . . . 0.0 110.404 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.58 -33.09 44.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.085 -1.01 . . . . 0.0 109.905 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.15 -55.87 28.38 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 108.929 -1.669 . . . . 0.0 108.929 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.483 ' CE2' HD13 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -48.23 -44.57 33.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.37 -1.077 . . . . 0.0 110.416 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.2 m -55.74 -37.41 68.44 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 110.264 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 86.3 t -80.4 -25.8 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.707 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -85.58 -58.34 2.7 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.999 -1.063 . . . . 0.0 109.158 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.25 -33.98 17.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.775 -0.578 . . . . 0.0 110.27 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.61 -33.77 53.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.166 -0.959 . . . . 0.0 109.976 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.59 -66.17 0.92 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -0.886 . . . . 0.0 110.105 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.79 -41.02 66.8 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 109.973 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.61 56.51 13.5 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.432 -0.793 . . . . 0.0 110.317 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.32 151.31 60.0 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.603 1.317 . . . . 0.0 110.307 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.65 -28.49 20.9 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.744 1.392 . . . . 0.0 110.327 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.6 120.3 31.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.369 -0.832 . . . . 0.0 110.052 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.483 HD13 ' CE2' ' B' ' 18' ' ' TYR . 9.1 tp -83.18 -36.36 24.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.247 -0.908 . . . . 0.0 110.216 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -51.17 -63.44 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.246 -0.909 . . . . 0.0 110.052 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.62 -35.76 72.99 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.412 -0.805 . . . . 0.0 110.17 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -66.55 -43.28 85.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.196 -0.94 . . . . 0.0 109.829 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.66 -35.45 74.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 110.258 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 91.0 t -74.24 -45.37 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.184 -0.948 . . . . 0.0 110.359 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.6 -20.56 66.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.57 -71.4 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.147 -0.971 . . . . 0.0 110.36 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -56.32 -47.2 79.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.928 . . . . 0.0 110.435 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 86.8 m -51.78 -42.88 62.75 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.173 -0.954 . . . . 0.0 110.307 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -75.06 -23.64 58.09 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.266 -0.896 . . . . 0.0 110.064 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -32.88 74.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.225 -0.922 . . . . 0.0 110.069 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -29.44 32.91 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.205 -0.934 . . . . 0.0 109.996 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 tp -87.82 -41.01 13.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.263 -1.14 . . . . 0.0 110.116 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.2 m -57.86 -57.61 12.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.976 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.08 21.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.404 -0.81 . . . . 0.0 109.984 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -49.58 14.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 109.997 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.39 -53.1 32.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.268 -0.895 . . . . 0.0 109.991 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.15 -43.16 63.92 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.818 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.15 -52.11 49.37 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.441 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.7 t80 -49.14 -49.34 42.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.405 -1.056 . . . . 0.0 110.17 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.0 m -55.7 -36.62 67.38 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.422 -0.799 . . . . 0.0 110.012 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.04 -25.1 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.249 -0.907 . . . . 0.0 110.601 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.468 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -86.87 -57.99 2.77 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.178 -0.951 . . . . 0.0 109.254 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.2 t -48.17 -30.99 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.753 -0.592 . . . . 0.0 110.484 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.8 tp -81.89 -37.71 26.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.189 -0.944 . . . . 0.0 110.128 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -27.73 51.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.481 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.421 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 3.5 pm0 -135.48 51.26 2.08 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.11 -0.994 . . . . 0.0 110.615 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -37.75 97.98 0.15 Allowed Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.964 -0.46 . . . . 0.0 111.458 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.421 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.6 Cg_endo -74.11 166.31 29.88 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.984 1.518 . . . . 0.0 110.552 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.59 -41.7 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.704 1.371 . . . . 0.0 110.273 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -122.04 116.38 24.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.896 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.83 -45.1 68.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.225 -0.922 . . . . 0.0 109.686 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -51.79 -59.88 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.902 . . . . 0.0 109.881 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.46 -38.74 78.16 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.582 -0.699 . . . . 0.0 109.994 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -60.31 -46.97 88.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.933 . . . . 0.0 109.685 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HB2' ' CD2' ' B' ' 38' ' ' PHE . . . -50.96 -38.44 50.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.425 -0.797 . . . . 0.0 110.389 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.422 ' O ' ' CB ' ' A' ' 39' ' ' THR . 46.4 t -71.48 -55.28 14.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.214 -0.929 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.37 -38.34 68.72 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.262 -0.899 . . . . 0.0 110.589 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.468 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 14.6 t80 -68.07 -64.87 0.78 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.55 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.475 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 23.1 m-85 -60.23 -45.58 92.74 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.256 -0.902 . . . . 0.0 110.665 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.422 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 96.6 m -56.44 -42.45 78.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.0 110.399 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -73.9 -27.11 60.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.12 -0.987 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.19 -36.71 78.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.254 -0.903 . . . . 0.0 110.269 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.58 -40.28 74.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 110.313 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.175 -0.953 . . . . 0.0 110.221 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.265 -1.534 . . . . 0.0 109.265 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 tp -87.84 -40.95 13.58 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.329 -1.101 . . . . 0.0 110.083 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 97.3 m -57.95 -57.54 12.34 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.168 -0.957 . . . . 0.0 109.941 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.15 21.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.365 -0.835 . . . . 0.0 109.911 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.34 -49.86 14.05 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.338 -0.851 . . . . 0.0 109.951 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.31 -52.96 34.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -43.06 64.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.113 -0.992 . . . . 0.0 109.766 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.33 -51.84 51.64 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 108.826 -1.71 . . . . 0.0 108.826 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.436 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.7 t80 -49.33 -49.28 44.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.41 -1.053 . . . . 0.0 110.119 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 45.3 m -55.69 -36.71 67.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.452 -0.78 . . . . 0.0 110.049 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.04 -25.04 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 110.518 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.46 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 1.0 OUTLIER -86.78 -58.2 2.69 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.039 -1.038 . . . . 0.0 109.338 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 41.1 t -48.04 -30.89 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.77 -0.582 . . . . 0.0 110.559 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 tp -82.06 -37.6 26.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.97 . . . . 0.0 110.099 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -27.84 50.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.258 -0.901 . . . . 0.0 110.415 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.423 ' O ' ' HD3' ' B' ' 27' ' ' PRO . 3.4 pm0 -135.44 51.45 2.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.135 -0.978 . . . . 0.0 110.52 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -37.94 98.05 0.15 Allowed Pre-proline 0 N--CA 1.5 2.035 0 O-C-N 122.009 -0.432 . . . . 0.0 111.464 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 47.8 Cg_endo -74.13 166.25 30.02 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.939 1.494 . . . . 0.0 110.58 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.48 -41.84 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.663 1.349 . . . . 0.0 110.263 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -121.93 116.49 24.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 110.268 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.99 -45.06 68.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 109.655 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.0 t -51.72 -59.95 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 109.776 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.41 -38.95 78.43 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.668 -0.645 . . . . 0.0 109.914 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -60.21 -46.86 88.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.927 . . . . 0.0 109.699 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.475 ' HB2' ' CD2' ' A' ' 38' ' ' PHE . . . -50.95 -38.55 51.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.369 -0.832 . . . . 0.0 110.333 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.428 ' O ' ' CB ' ' B' ' 39' ' ' THR . 46.4 t -71.39 -55.41 13.89 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.193 -0.942 . . . . 0.0 110.299 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -55.2 -38.4 68.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.46 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 14.6 t80 -68.14 -64.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.888 . . . . 0.0 110.501 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.495 ' CD2' ' HB2' ' A' ' 34' ' ' ALA . 23.4 m-85 -60.31 -45.38 93.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.733 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.428 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 96.9 m -56.66 -42.23 78.6 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.992 -1.068 . . . . 0.0 110.348 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -74.22 -26.88 60.51 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.29 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.26 -36.58 78.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.0 110.303 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.68 -40.28 75.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.236 -0.915 . . . . 0.0 110.409 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.163 -0.961 . . . . 0.0 110.232 179.933 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -51.16 5.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.174 -1.192 . . . . 0.0 110.27 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 m -52.79 -25.57 11.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.239 -0.913 . . . . 0.0 110.157 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.44 -58.96 3.32 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.165 -0.96 . . . . 0.0 110.239 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.68 -41.47 73.76 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.098 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.29 -44.81 95.05 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.328 -0.857 . . . . 0.0 110.087 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.05 -38.56 65.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.956 . . . . 0.0 109.698 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.53 -58.39 14.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.426 ' OH ' ' CB ' ' A' ' 34' ' ' ALA . 1.7 t80 -46.0 -40.24 10.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.511 -0.993 . . . . 0.0 110.685 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.2 m -62.7 -36.01 81.57 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.388 -0.82 . . . . 0.0 110.01 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 96.8 t -82.18 -21.84 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.26 -0.9 . . . . 0.0 110.745 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.454 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.24 8.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.028 -1.045 . . . . 0.0 109.332 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.438 HG12 ' CD1' ' A' ' 30' ' ' LEU . 76.9 t -60.71 -34.5 59.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 121.7 -0.625 . . . . 0.0 110.408 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.36 -41.32 22.18 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.124 -0.985 . . . . 0.0 110.277 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -69.57 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.38 -36.87 64.35 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.253 -0.904 . . . . 0.0 110.173 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.11 59.6 14.47 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.23 -0.919 . . . . 0.0 110.157 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.98 149.8 59.73 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.715 1.376 . . . . 0.0 110.508 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.99 -29.98 17.25 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.723 1.38 . . . . 0.0 110.294 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -125.06 119.64 29.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.438 ' CD1' HG12 ' A' ' 22' ' ' VAL . 5.3 tp -78.6 -35.68 45.39 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.246 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -51.05 -68.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.228 -0.92 . . . . 0.0 110.108 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.99 -41.54 71.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.469 -0.77 . . . . 0.0 109.785 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -58.58 -51.81 68.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.534 179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.426 ' CB ' ' OH ' ' A' ' 18' ' ' TYR . . . -53.66 -44.62 69.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.439 -0.788 . . . . 0.0 110.022 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.437 HG23 ' N ' ' B' ' 39' ' ' THR . 92.9 t -71.04 -29.74 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 O-C-N 121.315 -0.866 . . . . 0.0 110.07 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.23 -26.6 39.02 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.259 -0.901 . . . . 0.0 109.586 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.454 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 27.8 t80 -76.57 -68.12 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.206 -0.933 . . . . 0.0 110.427 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -52.94 -45.81 67.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.304 -0.872 . . . . 0.0 110.65 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.407 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 24.0 m -54.51 -40.89 69.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.983 -1.073 . . . . 0.0 109.889 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -28.75 68.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 mt -75.57 -24.65 56.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 110.337 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -47.91 50.11 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.225 -0.922 . . . . 0.0 109.695 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.356 -0.84 . . . . 0.0 110.047 179.871 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.58 -51.06 5.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.134 -1.215 . . . . 0.0 110.293 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 69.3 m -52.98 -25.57 12.48 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.224 -0.922 . . . . 0.0 110.205 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -69.33 -59.09 3.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 110.16 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.51 -41.56 73.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.14 -44.91 94.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.191 -0.943 . . . . 0.0 110.128 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -38.58 65.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.74 -58.23 15.66 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.93 -1.668 . . . . 0.0 108.93 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.423 ' OH ' ' CB ' ' B' ' 34' ' ' ALA . 1.7 t80 -45.92 -40.33 10.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.534 -0.98 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 80.1 m -62.72 -35.97 81.47 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.104 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 98.8 t -82.27 -21.72 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.749 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.464 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.39 8.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.082 -1.011 . . . . 0.0 109.213 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.437 HG12 ' CD1' ' B' ' 30' ' ' LEU . 73.6 t -60.6 -34.55 58.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.762 -0.586 . . . . 0.0 110.452 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.26 -41.34 22.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.122 -0.986 . . . . 0.0 110.251 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -69.62 0.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.302 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.24 -36.75 63.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.304 -0.873 . . . . 0.0 110.269 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 51.94 59.77 14.47 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.267 -0.896 . . . . 0.0 110.174 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.02 149.76 59.43 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.682 1.359 . . . . 0.0 110.529 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -71.04 -29.98 17.06 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.655 1.345 . . . . 0.0 110.327 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -125.03 119.6 29.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.134 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.437 ' CD1' HG12 ' B' ' 22' ' ' VAL . 5.3 tp -78.43 -35.9 46.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.191 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.5 t -50.88 -68.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.277 -0.89 . . . . 0.0 110.203 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.94 -41.61 71.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.394 -0.816 . . . . 0.0 109.711 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -58.54 -51.99 67.56 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.294 -0.879 . . . . 0.0 109.511 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.423 ' CB ' ' OH ' ' B' ' 18' ' ' TYR . . . -53.66 -44.5 69.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.363 -0.836 . . . . 0.0 110.027 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.407 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 90.9 t -71.13 -29.73 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.269 -0.895 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.06 -26.6 39.59 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.241 -0.912 . . . . 0.0 109.546 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.464 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 27.8 t80 -76.67 -68.03 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.17 -0.956 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -53.03 -45.7 68.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.592 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.437 ' N ' HG23 ' A' ' 35' ' ' VAL . 23.8 m -54.55 -41.11 69.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.022 -1.049 . . . . 0.0 109.753 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -28.83 68.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.188 -0.945 . . . . 0.0 109.974 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.1 mt -75.64 -24.65 56.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 110.341 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -47.78 51.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.169 -0.957 . . . . 0.0 109.684 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.972 179.841 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -38.49 91.02 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -1.158 . . . . 0.0 110.204 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -53.79 -43.18 69.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.347 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.86 -25.34 66.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.924 . . . . 0.0 110.367 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tp -71.68 -53.07 14.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.4 mt -60.2 -44.49 95.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.08 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -38.21 63.42 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.173 -0.955 . . . . 0.0 109.878 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.29 -57.05 21.16 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.427 ' OH ' ' CB ' ' A' ' 34' ' ' ALA . 1.8 t80 -46.65 -40.57 13.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.524 -0.986 . . . . 0.0 110.575 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.7 m -62.3 -36.57 82.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.394 -0.816 . . . . 0.0 110.267 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.82 -23.37 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.338 -0.851 . . . . 0.0 110.713 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -87.43 -54.36 4.33 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.01 -1.056 . . . . 0.0 109.246 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.15 -33.79 25.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.281 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 mt -78.35 -36.36 46.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.133 -0.98 . . . . 0.0 110.158 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -55.85 4.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.219 -0.926 . . . . 0.0 110.193 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.18 -44.13 97.79 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.294 -0.879 . . . . 0.0 110.203 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.63 58.13 14.83 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.296 -0.877 . . . . 0.0 110.312 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -72.35 156.69 54.48 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.589 1.31 . . . . 0.0 110.364 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.45 -19.05 33.33 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.743 1.391 . . . . 0.0 110.509 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.13 119.36 15.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.256 -0.902 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -81.16 -36.25 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.136 -0.977 . . . . 0.0 110.017 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.68 -65.5 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -0.909 . . . . 0.0 109.765 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.24 -41.73 76.19 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.427 -0.795 . . . . 0.0 109.732 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -57.65 -49.23 77.17 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.344 -0.847 . . . . 0.0 109.657 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.427 ' CB ' ' OH ' ' A' ' 18' ' ' TYR . . . -51.93 -34.97 44.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.357 -0.839 . . . . 0.0 110.226 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.29 -53.42 17.23 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.347 -0.846 . . . . 0.0 110.427 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.23 -23.15 46.12 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.0 110.319 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -79.1 -68.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.266 -0.896 . . . . 0.0 110.377 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.429 ' CG ' ' HB2' ' B' ' 34' ' ' ALA . 13.1 m-85 -57.08 -45.72 83.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.237 -0.914 . . . . 0.0 110.39 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 83.5 m -53.57 -48.88 68.76 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.937 . . . . 0.0 110.442 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -35.56 80.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.148 -0.97 . . . . 0.0 110.257 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.3 -43.39 67.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.0 110.27 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 -44.44 62.66 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.182 -0.949 . . . . 0.0 110.452 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.99 179.843 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.35 90.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.284 -1.127 . . . . 0.0 110.171 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.0 m -54.03 -43.04 69.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.396 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.82 -25.4 66.42 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.277 -0.889 . . . . 0.0 110.317 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tp -71.72 -52.85 15.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.242 -0.911 . . . . 0.0 110.256 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.36 -44.27 95.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.905 . . . . 0.0 110.067 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -38.3 64.26 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.141 -0.974 . . . . 0.0 109.774 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.13 -57.18 20.4 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.42 ' OH ' ' CB ' ' B' ' 34' ' ' ALA . 1.8 t80 -46.6 -40.39 12.82 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.53 -0.982 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -62.6 -36.29 82.26 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.437 -0.789 . . . . 0.0 110.296 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.96 -23.39 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.759 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -87.58 -54.18 4.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.056 -1.028 . . . . 0.0 109.289 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.18 -33.49 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 O-C-N 121.786 -0.571 . . . . 0.0 110.294 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 mt -78.6 -36.46 44.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.135 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.11 -55.83 4.31 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.26 -44.01 97.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.6 58.1 14.88 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.319 -0.863 . . . . 0.0 110.383 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.42 156.62 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.586 1.309 . . . . 0.0 110.498 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.27 -19.15 34.03 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.709 1.373 . . . . 0.0 110.47 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.16 119.19 15.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.236 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.98 -36.23 31.03 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.022 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.62 -65.67 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.289 -0.882 . . . . 0.0 109.789 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.06 -41.71 75.48 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.52 -0.737 . . . . 0.0 109.744 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.327 -0.858 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.429 ' HB2' ' CG ' ' A' ' 38' ' ' PHE . . . -52.18 -34.89 47.14 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.348 -0.845 . . . . 0.0 110.194 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.29 -53.51 16.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.349 -0.844 . . . . 0.0 110.452 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -57.14 -23.24 45.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.428 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -79.06 -68.18 0.68 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.275 -0.891 . . . . 0.0 110.438 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.42 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 13.2 m-85 -57.2 -45.75 83.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.154 -0.966 . . . . 0.0 110.414 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -53.42 -49.22 67.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.255 -0.903 . . . . 0.0 110.436 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.05 -35.78 81.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.155 -0.965 . . . . 0.0 110.298 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.13 -43.42 66.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.5 -44.55 62.56 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.293 -0.879 . . . . 0.0 110.47 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.29 -0.881 . . . . 0.0 109.965 179.828 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 p80 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.206 0.527 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 ttp -118.92 -31.87 4.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.292 -0.88 . . . . 0.0 110.302 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -169.81 -167.08 29.8 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -103.26 18.71 21.14 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.265 -1.138 . . . . 0.0 110.356 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.2 mp -134.46 100.1 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.2 -0.937 . . . . 0.0 110.035 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.02 50.27 0.79 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.311 -0.868 . . . . 0.0 110.113 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.403 HG13 ' HD2' ' A' ' 8' ' ' PRO . 1.3 tt -58.96 130.6 86.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 O-C-N 121.286 -0.884 . . . . 0.0 110.153 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.403 ' HD2' HG13 ' A' ' 7' ' ' ILE . 46.5 Cg_endo -72.61 137.04 26.93 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.495 1.26 . . . . 0.0 110.398 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.7 178.72 5.98 Favored 'Trans proline' 0 C--N 1.312 -1.366 0 O-C-N 123.535 1.281 . . . . 0.0 110.472 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.0 -32.42 6.4 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.67 -57.33 5.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.208 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.6 m -52.4 -28.58 20.36 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.242 -0.911 . . . . 0.0 110.262 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -72.04 -59.19 2.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -39.44 69.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.923 . . . . 0.0 110.199 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.0 mt -62.91 -43.99 97.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.95 . . . . 0.0 109.957 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.36 -37.95 65.53 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.16 -0.963 . . . . 0.0 109.653 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.44 -55.24 30.69 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.424 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.6 t80 -48.14 -38.83 18.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.404 -1.057 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.85 -36.52 83.53 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.472 -0.768 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.9 -25.07 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.773 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.6 mt-10 -82.69 -57.15 3.45 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.416 HG12 ' CD1' ' A' ' 30' ' ' LEU . 22.6 t -55.53 -32.91 31.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.126 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.1 -34.53 63.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.261 -0.9 . . . . 0.0 110.233 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.49 -62.59 1.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.204 -0.935 . . . . 0.0 110.362 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.16 -43.12 63.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.216 -0.927 . . . . 0.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.42 62.41 11.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.287 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.23 161.62 45.2 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 O-C-N 123.734 1.386 . . . . 0.0 110.527 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.19 -34.12 10.52 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.638 1.336 . . . . 0.0 110.423 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -129.05 123.85 33.38 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.289 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.416 ' CD1' HG12 ' A' ' 22' ' ' VAL . 3.7 tp -77.7 -40.9 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 0.0 110.176 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.1 t -50.74 -65.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.907 . . . . 0.0 110.019 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.21 -38.95 71.72 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.5 -0.75 . . . . 0.0 110.07 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -62.17 -46.44 88.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.209 -0.932 . . . . 0.0 109.878 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.482 ' HB2' ' CG ' ' B' ' 38' ' ' PHE . . . -54.33 -33.28 58.58 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 0.0 110.197 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 85.7 t -74.96 -49.97 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.333 -0.855 . . . . 0.0 110.248 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.32 -41.03 96.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.236 -0.915 . . . . 0.0 110.332 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.467 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.2 t80 -61.5 -60.12 4.19 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.918 . . . . 0.0 110.3 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.487 ' CG ' ' HB2' ' B' ' 34' ' ' ALA . 12.5 m-85 -63.62 -47.78 79.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 54.6 m -52.98 -29.88 31.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.948 . . . . 0.0 109.939 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.13 -34.5 37.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.336 -0.852 . . . . 0.0 109.827 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -23.08 63.76 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.322 -0.861 . . . . 0.0 110.068 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -75.36 -26.4 58.5 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.221 -0.924 . . . . 0.0 109.732 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -105.76 8.14 32.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.31 -0.869 . . . . 0.0 110.484 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -92.98 -65.32 1.01 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.023 -1.048 . . . . 0.0 110.116 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.79 106.39 0.09 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.556 -0.715 . . . . 0.0 110.59 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.7 mtt180 . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.258 -179.838 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 p80 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.204 0.526 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.9 ttp -119.01 -31.52 4.72 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.298 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.03 -167.28 30.28 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -103.19 18.73 21.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.293 -1.122 . . . . 0.0 110.423 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 4.2 mp -134.59 100.22 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.181 -0.95 . . . . 0.0 109.975 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.04 50.34 0.79 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.268 -0.895 . . . . 0.0 110.073 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . 0.405 HG13 ' HD2' ' B' ' 8' ' ' PRO . 1.3 tt -58.97 130.57 86.47 Favored Pre-proline 0 C--N 1.305 -1.353 0 O-C-N 121.266 -0.896 . . . . 0.0 110.164 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.405 ' HD2' HG13 ' B' ' 7' ' ' ILE . 45.9 Cg_endo -72.6 137.01 26.89 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.461 1.243 . . . . 0.0 110.47 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.71 178.65 6.06 Favored 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.574 1.302 . . . . 0.0 110.431 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.26 -32.81 6.1 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -57.45 5.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -1.167 . . . . 0.0 110.235 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.6 m -52.27 -28.6 19.47 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.206 -0.934 . . . . 0.0 110.315 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -71.94 -59.2 2.86 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.184 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.27 -39.16 69.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.261 -0.9 . . . . 0.0 110.289 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.18 -43.96 96.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.239 -0.913 . . . . 0.0 109.997 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -37.88 65.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.216 -0.928 . . . . 0.0 109.65 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.31 -55.35 29.96 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.419 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.6 t80 -48.14 -38.82 18.85 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -1.048 . . . . 0.0 110.363 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -36.32 82.93 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.465 -0.772 . . . . 0.0 110.211 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 90.4 t -80.98 -25.24 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.789 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.7 mt-10 -82.53 -57.14 3.47 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.1 -1.0 . . . . 0.0 109.284 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.427 HG12 ' CD1' ' B' ' 30' ' ' LEU . 22.4 t -55.63 -32.75 31.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 O-C-N 121.708 -0.62 . . . . 0.0 110.101 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.3 -34.38 63.49 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.65 -62.41 1.4 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.25 -0.906 . . . . 0.0 110.346 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.27 -43.22 64.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.311 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.51 62.41 11.12 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.281 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.22 161.51 45.58 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.692 1.364 . . . . 0.0 110.538 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.0 -34.33 10.61 Favored 'Trans proline' 0 C--N 1.31 -1.471 0 O-C-N 123.723 1.38 . . . . 0.0 110.456 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -128.89 124.09 34.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.287 -0.883 . . . . 0.0 110.226 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.427 ' CD1' HG12 ' B' ' 22' ' ' VAL . 3.7 tp -77.8 -41.05 38.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 110.082 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 46.6 t -50.52 -65.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.245 -0.909 . . . . 0.0 110.046 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.17 -38.99 71.67 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.487 -0.758 . . . . 0.0 110.041 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -62.07 -46.5 88.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.898 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.487 ' HB2' ' CG ' ' A' ' 38' ' ' PHE . . . -54.3 -33.44 58.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.437 -0.79 . . . . 0.0 110.217 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.402 ' O ' ' CB ' ' B' ' 39' ' ' THR . 86.7 t -74.87 -49.84 27.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.55 -40.76 95.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.353 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 33.0 t80 -61.65 -60.22 4.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.198 -0.939 . . . . 0.0 110.282 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.482 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 12.5 m-85 -63.48 -47.61 81.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.343 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.402 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 52.9 m -53.13 -29.94 34.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.123 -0.986 . . . . 0.0 109.972 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.1 -34.49 37.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 109.87 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.11 -23.09 63.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.337 -0.852 . . . . 0.0 110.084 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -75.43 -26.47 58.37 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.281 -0.887 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -105.71 8.03 32.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.893 . . . . 0.0 110.499 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -92.73 -65.41 1.0 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.03 -1.044 . . . . 0.0 110.123 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.74 106.34 0.09 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.594 -0.691 . . . . 0.0 110.611 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.276 -179.832 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 67.1 m80 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.252 0.548 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ttp -105.61 -42.19 5.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.231 -0.918 . . . . 0.0 110.168 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.47 158.1 0.88 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -134.65 -50.57 0.78 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.316 -1.108 . . . . 0.0 110.193 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -120.06 45.66 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 110.161 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -141.13 38.65 1.76 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.246 -0.909 . . . . 0.0 110.288 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.2 mm -115.26 119.7 37.97 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.188 -0.945 . . . . 0.0 110.131 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.71 113.77 3.84 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 O-C-N 123.548 1.288 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.2 151.3 48.96 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 O-C-N 123.547 1.288 . . . . 0.0 110.332 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.69 -27.06 21.48 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.94 -32.38 72.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -1.172 . . . . 0.0 110.188 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.8 m -69.72 -30.88 68.61 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.158 -0.964 . . . . 0.0 110.228 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -71.48 -54.54 10.26 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.269 -0.894 . . . . 0.0 110.208 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.443 HD23 ' CE1' ' A' ' 38' ' ' PHE . 1.0 OUTLIER -55.59 -53.56 54.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.261 -0.899 . . . . 0.0 110.241 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -53.55 -38.86 64.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.227 -0.921 . . . . 0.0 110.193 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -43.93 70.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.14 -0.975 . . . . 0.0 109.956 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.67 -55.69 27.5 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -49.24 -47.48 46.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.42 -1.047 . . . . 0.0 110.31 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 77.7 m -53.15 -36.18 60.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.393 -0.817 . . . . 0.0 110.316 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.26 -25.0 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.174 -0.954 . . . . 0.0 110.417 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.4 mt-10 -89.13 -60.15 2.03 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.21 -0.931 . . . . 0.0 109.2 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.4 t -53.59 -26.71 13.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.75 -0.594 . . . . 0.0 110.116 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.409 ' CB ' ' O ' ' A' ' 19' ' ' THR . 2.7 tp -85.08 -35.69 21.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.295 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.27 -56.25 3.34 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.362 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.39 -41.94 81.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.158 -0.964 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 52.04 59.07 15.19 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.245 -0.909 . . . . 0.0 110.161 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.26 156.77 58.53 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.675 1.355 . . . . 0.0 110.573 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.45 -27.48 19.05 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.764 1.402 . . . . 0.0 110.453 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.19 119.93 21.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.41 -32.63 28.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.142 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.8 t -53.14 -64.67 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.251 -0.905 . . . . 0.0 109.829 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.91 77.81 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.527 -0.733 . . . . 0.0 109.958 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.55 -48.38 81.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.931 . . . . 0.0 109.521 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.4 -35.06 64.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.873 . . . . 0.0 109.585 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.432 ' CG1' ' OG1' ' B' ' 39' ' ' THR . 55.3 t -81.85 -44.37 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.424 -0.797 . . . . 0.0 109.723 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -26.76 66.96 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.222 -0.924 . . . . 0.0 109.855 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.442 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 38.3 t80 -78.88 -68.02 0.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 110.296 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.443 ' CE1' HD23 ' A' ' 14' ' ' LEU . 17.0 m-85 -52.21 -50.97 60.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.206 -0.934 . . . . 0.0 110.49 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.423 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 90.4 m -50.68 -52.92 35.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.36 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -63.43 -24.07 67.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.05 -29.35 70.23 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 109.997 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -58.14 9.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.332 -0.855 . . . . 0.0 110.174 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -60.63 -23.74 64.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.324 -0.86 . . . . 0.0 110.35 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.74 -71.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.287 -0.883 . . . . 0.0 110.449 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -49.77 -32.83 14.71 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.522 -0.736 . . . . 0.0 110.659 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.227 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 67.4 m80 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.303 0.573 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ttp -105.52 -42.28 5.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.315 -0.866 . . . . 0.0 110.196 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.55 158.16 0.91 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -134.75 -50.72 0.78 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -1.16 . . . . 0.0 110.137 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.95 45.56 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.402 -0.811 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -140.9 38.59 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 110.352 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 36.1 mm -115.35 119.75 37.71 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.259 -0.901 . . . . 0.0 110.085 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.7 113.69 3.81 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.523 1.275 . . . . 0.0 110.5 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.03 151.39 49.95 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.591 1.311 . . . . 0.0 110.361 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -26.96 21.72 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.5 tp -67.94 -32.46 72.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -1.149 . . . . 0.0 110.144 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 86.0 m -69.8 -30.68 68.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.304 -0.872 . . . . 0.0 110.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -71.61 -54.4 10.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.44 HD23 ' CE1' ' B' ' 38' ' ' PHE . 1.0 OUTLIER -55.77 -53.51 55.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -53.5 -38.96 64.2 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.32 -0.863 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -44.17 70.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.283 -0.886 . . . . 0.0 109.946 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.37 -55.96 25.83 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -49.0 -47.49 44.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.373 -1.075 . . . . 0.0 110.401 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' THR . . . . . 0.412 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 76.1 m -53.22 -36.14 60.7 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.423 -0.798 . . . . 0.0 110.323 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -78.19 -25.2 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.246 -0.909 . . . . 0.0 110.4 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.455 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.4 mt-10 -88.91 -60.14 2.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.236 -0.915 . . . . 0.0 109.257 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 25.0 t -53.51 -26.78 13.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.676 -0.64 . . . . 0.0 110.149 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . 0.412 ' CB ' ' O ' ' B' ' 19' ' ' THR . 2.7 tp -85.05 -35.73 21.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 -56.32 3.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.893 . . . . 0.0 110.335 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.26 -41.88 80.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.135 -0.978 . . . . 0.0 110.49 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 51.92 59.17 15.22 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.192 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 156.89 57.87 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 O-C-N 123.755 1.397 . . . . 0.0 110.535 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.54 -27.48 18.75 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.676 1.356 . . . . 0.0 110.411 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.2 119.9 21.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.37 -32.84 29.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.886 . . . . 0.0 110.16 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.8 t -52.9 -64.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.264 -0.897 . . . . 0.0 109.865 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.94 77.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.558 -0.714 . . . . 0.0 109.976 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -61.44 -48.52 80.8 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.19 -0.944 . . . . 0.0 109.54 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.32 -35.28 64.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.375 -0.828 . . . . 0.0 109.573 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.423 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 57.1 t -81.66 -44.17 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 O-C-N 121.477 -0.764 . . . . 0.0 109.783 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.27 -26.65 66.67 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.455 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 38.4 t80 -78.98 -67.9 0.71 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.146 -0.971 . . . . 0.0 110.283 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.44 ' CE1' HD23 ' B' ' 14' ' ' LEU . 16.9 m-85 -52.22 -51.01 60.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.239 -0.913 . . . . 0.0 110.426 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.432 ' OG1' ' CG1' ' A' ' 35' ' ' VAL . 84.8 m -50.69 -52.94 35.31 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.38 -24.2 67.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.342 -0.849 . . . . 0.0 109.955 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -64.91 -29.33 70.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.095 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -58.25 9.3 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.328 -0.857 . . . . 0.0 110.127 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -60.52 -23.64 64.72 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.0 -71.81 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.471 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -49.64 -32.89 14.03 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.54 -0.725 . . . . 0.0 110.727 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.6 m80 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.42 76.81 0.69 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.27 -139.96 14.92 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.0 169.97 18.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.187 -1.184 . . . . 0.0 110.219 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.435 ' N ' HD11 ' A' ' 5' ' ' ILE . 4.3 mp -113.92 148.84 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.263 -0.898 . . . . 0.0 110.073 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -131.07 143.52 50.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.251 -0.906 . . . . 0.0 110.117 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.425 ' CD1' ' O ' ' A' ' 7' ' ' ILE . 1.3 pp -146.83 58.32 4.25 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.279 -0.888 . . . . 0.0 110.442 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.36 145.76 54.56 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.75 1.395 . . . . 0.0 110.706 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -74.32 -171.69 0.98 Allowed 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.705 1.371 . . . . 0.0 110.425 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.32 -43.84 2.8 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.3 tp -77.5 -38.57 48.67 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -1.152 . . . . 0.0 110.37 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.7 m -63.46 -37.93 89.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.205 -0.935 . . . . 0.0 110.383 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.04 -41.76 68.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 110.282 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.56 -44.13 71.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.225 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 91.8 mt -67.83 -51.58 46.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 0.0 110.173 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.42 -34.61 25.11 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.068 -1.02 . . . . 0.0 109.932 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.44 -58.74 12.81 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.425 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.3 t80 -47.54 -44.56 26.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.447 -1.031 . . . . 0.0 110.663 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 m -50.74 -55.72 15.36 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.048 -1.033 . . . . 0.0 108.906 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.79 -44.27 98.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.55 -69.05 0.12 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.426 0.632 . . . . 0.0 110.768 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -52.44 -22.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.389 -0.819 . . . . 0.0 110.519 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.88 -20.99 34.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 110.195 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.77 -56.53 2.26 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.215 -0.928 . . . . 0.0 110.163 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -57.09 -43.58 82.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.26 -0.9 . . . . 0.0 110.148 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.454 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 0.0 OUTLIER 52.57 52.79 11.43 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.372 -0.83 . . . . 0.0 110.162 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 45.1 Cg_endo -71.28 156.18 59.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.633 1.333 . . . . 0.0 110.395 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.33 -29.84 16.4 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.658 1.346 . . . . 0.0 110.167 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.64 119.59 29.45 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.46 -41.93 23.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 0.0 110.346 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -50.7 -59.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.234 -0.916 . . . . 0.0 110.047 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -62.01 -36.02 80.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.508 -0.745 . . . . 0.0 110.024 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.408 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 53.3 t80 -65.49 -44.11 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.287 -0.883 . . . . 0.0 109.706 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.425 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.12 -36.07 70.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.443 -0.786 . . . . 0.0 110.124 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.429 HG23 ' N ' ' B' ' 39' ' ' THR . 98.1 t -78.06 -44.91 27.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.56 -30.29 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.386 -0.821 . . . . 0.0 110.55 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -76.71 -58.26 3.38 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.157 -0.964 . . . . 0.0 110.376 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -65.57 -43.17 90.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.546 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.421 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 53.7 m -54.68 -44.83 73.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.081 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.91 -31.92 72.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.172 -0.955 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -28.19 68.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 109.975 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.405 ' HB3' ' CZ ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -68.6 -30.32 69.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.03 -33.89 75.45 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.293 -0.88 . . . . 0.0 110.072 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.94 -64.42 0.82 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.829 . . . . 0.0 110.234 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -48.96 160.58 0.18 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.597 -0.689 . . . . 0.0 110.558 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.255 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 5.6 m80 . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.23 0.538 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.45 76.72 0.69 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.295 -0.878 . . . . 0.0 110.142 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.25 -139.85 14.87 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.02 169.88 18.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.185 -1.185 . . . . 0.0 110.319 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.435 HD11 ' N ' ' B' ' 5' ' ' ILE . 4.3 mp -113.86 148.76 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.33 -0.856 . . . . 0.0 110.038 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -131.1 143.43 50.65 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . 0.425 ' O ' ' CD1' ' B' ' 7' ' ' ILE . 1.3 pp -146.84 58.54 4.41 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.271 -0.893 . . . . 0.0 110.364 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.49 145.85 54.03 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.64 1.337 . . . . 0.0 110.637 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.34 -171.57 0.95 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.669 1.352 . . . . 0.0 110.515 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.29 -44.03 2.8 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -77.48 -38.46 49.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.201 -1.176 . . . . 0.0 110.386 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 57.0 m -63.48 -38.1 89.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.11 -0.994 . . . . 0.0 110.331 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.84 -41.79 67.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.257 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.65 -43.99 71.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 110.29 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 92.1 mt -67.87 -51.36 49.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 110.151 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.68 -34.46 26.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.157 -0.964 . . . . 0.0 110.005 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.64 -58.5 13.95 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.414 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.3 t80 -47.76 -44.55 28.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -1.016 . . . . 0.0 110.602 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -50.6 -55.7 15.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.047 -1.033 . . . . 0.0 108.878 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.5 t -63.82 -44.38 98.15 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.407 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER -52.49 -69.01 0.12 Allowed 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.374 0.607 . . . . 0.0 110.734 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.8 t -52.52 -22.73 3.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 O-C-N 121.38 -0.825 . . . . 0.0 110.498 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.8 -21.47 34.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.109 -0.995 . . . . 0.0 110.059 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.28 -56.43 2.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.283 -0.886 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -57.27 -43.68 83.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.158 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.0 OUTLIER 52.84 52.6 10.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.378 -0.826 . . . . 0.0 110.163 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 44.3 Cg_endo -71.05 156.14 60.43 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.639 1.337 . . . . 0.0 110.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.38 -29.63 16.56 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.667 1.351 . . . . 0.0 110.094 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.76 119.43 28.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.365 -0.834 . . . . 0.0 110.109 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.5 -42.03 23.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.239 -0.913 . . . . 0.0 110.254 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -50.66 -59.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.931 . . . . 0.0 110.051 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -62.05 -35.98 80.25 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.59 -0.694 . . . . 0.0 109.971 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 53.2 t80 -65.52 -43.85 88.76 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.309 -0.87 . . . . 0.0 109.656 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.414 ' CA ' ' OH ' ' B' ' 18' ' ' TYR . . . -57.59 -36.07 71.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.372 -0.83 . . . . 0.0 110.097 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.427 ' O ' ' CB ' ' B' ' 39' ' ' THR . 92.4 t -78.02 -44.68 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 O-C-N 121.202 -0.936 . . . . 0.0 110.154 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.69 -30.64 68.92 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.331 -0.856 . . . . 0.0 110.573 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.407 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 74.0 t80 -76.35 -58.32 3.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.129 -0.982 . . . . 0.0 110.367 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.403 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 12.7 m-85 -65.58 -42.52 91.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.597 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.429 ' N ' HG23 ' A' ' 35' ' ' VAL . 53.5 m -55.24 -44.72 75.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.003 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.96 -32.11 72.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.02 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -28.39 68.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.277 -0.89 . . . . 0.0 109.968 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -30.09 68.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.286 -0.884 . . . . 0.0 110.195 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.29 -33.83 75.05 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.918 . . . . 0.0 110.086 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -53.03 -64.14 0.92 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.897 . . . . 0.0 110.273 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.1 160.66 0.19 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.492 -0.755 . . . . 0.0 110.514 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.183 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.247 0.546 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttt -152.4 34.23 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.32 -0.862 . . . . 0.0 110.146 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.81 64.21 0.32 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -151.14 157.2 42.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tp -100.26 60.1 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.277 -0.889 . . . . 0.0 110.153 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.89 -171.48 1.88 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.266 -0.896 . . . . 0.0 110.234 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.477 ' N ' ' CD1' ' A' ' 7' ' ' ILE . 1.8 mp -93.51 138.35 23.0 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 109.536 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.02 151.08 55.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.689 1.363 . . . . 0.0 110.715 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.11 173.96 12.1 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.785 1.413 . . . . 0.0 110.345 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.46 -41.07 2.53 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -73.76 -28.44 61.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.314 -1.109 . . . . 0.0 110.184 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.5 m -71.64 -43.67 65.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.079 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.9 -36.66 62.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -0.875 . . . . 0.0 110.435 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.83 -50.39 35.98 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.895 . . . . 0.0 110.404 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.68 -49.14 72.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.19 -0.944 . . . . 0.0 110.136 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.97 -34.71 60.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.145 -0.972 . . . . 0.0 109.772 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.96 -52.8 46.6 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 108.705 -1.758 . . . . 0.0 108.705 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.432 ' OH ' ' N ' ' A' ' 34' ' ' ALA . 1.4 t80 -47.67 -37.9 13.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.492 -1.005 . . . . 0.0 110.149 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -65.77 -33.05 74.96 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.585 -0.697 . . . . 0.0 110.335 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.8 t -81.3 -27.28 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 110.687 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -80.79 -56.9 3.82 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.055 -1.028 . . . . 0.0 109.378 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.8 t -56.7 -31.91 36.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.763 -0.585 . . . . 0.0 110.294 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -75.15 -30.76 60.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.236 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.03 -51.71 4.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.205 -0.934 . . . . 0.0 110.484 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.6 -34.49 67.43 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.224 -0.922 . . . . 0.0 109.961 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.97 71.3 1.53 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.267 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.83 169.74 20.48 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.652 1.343 . . . . 0.0 110.462 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.12 -37.98 7.59 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.734 1.386 . . . . 0.0 110.331 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -145.37 148.14 33.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.264 -0.898 . . . . 0.0 110.087 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 mt -83.71 -41.05 18.12 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.244 -0.91 . . . . 0.0 110.176 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.2 t -52.13 -63.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.216 -0.928 . . . . 0.0 109.848 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.62 -39.66 85.0 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.539 -0.725 . . . . 0.0 109.882 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.423 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 34.1 t80 -62.83 -51.36 67.35 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 109.783 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.458 ' HB2' ' CD2' ' B' ' 38' ' ' PHE . . . -55.28 -33.88 63.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.387 -0.821 . . . . 0.0 110.004 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.405 ' O ' ' CB ' ' A' ' 39' ' ' THR . 68.9 t -75.4 -50.51 23.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.32 -0.862 . . . . 0.0 110.198 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.46 -28.8 70.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.211 -0.93 . . . . 0.0 110.485 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -77.76 -63.08 1.47 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.219 -0.925 . . . . 0.0 110.471 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 18.6 m-85 -58.6 -43.66 89.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.23 -0.919 . . . . 0.0 110.506 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 65.3 m -57.76 -46.24 84.79 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.335 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.04 -21.62 61.51 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.389 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -77.29 -20.3 55.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.381 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -23.0 43.74 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.227 -0.92 . . . . 0.0 109.758 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.6 -19.47 52.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.098 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.44 -57.43 2.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 110.398 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -47.89 -28.13 2.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.604 -0.685 . . . . 0.0 110.888 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.19 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.233 0.54 . . . . 0.0 110.14 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttt -152.33 34.13 0.51 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.273 -0.892 . . . . 0.0 110.175 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.68 64.23 0.33 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -151.27 157.2 42.25 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -1.164 . . . . 0.0 110.175 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tp -100.22 59.97 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.314 -0.866 . . . . 0.0 110.254 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -107.71 -171.21 1.83 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.208 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . 0.481 ' N ' ' CD1' ' B' ' 7' ' ' ILE . 1.8 mp -93.81 138.35 22.81 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.195 -0.941 . . . . 0.0 109.495 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.92 151.09 56.2 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.64 1.337 . . . . 0.0 110.651 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.12 174.05 11.97 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.7 1.369 . . . . 0.0 110.397 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.32 -40.72 2.61 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -74.14 -28.39 61.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -1.135 . . . . 0.0 110.136 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.7 m -71.67 -43.69 65.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 110.125 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.83 -36.56 62.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.252 -0.905 . . . . 0.0 110.456 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tp -70.83 -50.44 35.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.175 -0.953 . . . . 0.0 110.336 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.71 -49.14 72.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.95 -34.94 61.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.066 -1.022 . . . . 0.0 109.633 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.67 -53.01 44.5 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.429 ' OH ' ' N ' ' B' ' 34' ' ' ALA . 1.4 t80 -47.61 -37.96 13.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.459 -1.024 . . . . 0.0 110.097 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.3 m -65.75 -32.93 74.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.584 -0.698 . . . . 0.0 110.401 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 55.8 t -81.3 -27.46 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 110.739 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.57 -57.16 3.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.216 -0.927 . . . . 0.0 109.43 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 26.1 t -56.45 -31.84 34.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.76 -0.588 . . . . 0.0 110.305 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 47.7 tp -75.31 -30.57 60.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.221 -0.924 . . . . 0.0 110.334 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.18 -51.65 4.33 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 0.0 110.486 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.71 -34.64 67.25 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.27 -0.894 . . . . 0.0 109.797 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.21 71.15 1.56 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.283 -0.885 . . . . 0.0 110.304 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.79 169.82 20.23 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.591 1.311 . . . . 0.0 110.466 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.18 -37.78 7.71 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.691 1.364 . . . . 0.0 110.315 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -145.61 148.05 32.7 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 110.084 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 mt -83.59 -41.28 18.03 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 41.0 t -51.88 -63.36 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.916 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.68 -39.63 85.15 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.531 -0.731 . . . . 0.0 109.893 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.424 ' CD2' ' CE1' ' B' ' 18' ' ' TYR . 34.2 t80 -62.84 -51.11 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.795 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.431 ' HB2' ' CD2' ' A' ' 38' ' ' PHE . . . -55.53 -33.89 64.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 109.959 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.403 ' O ' ' CB ' ' B' ' 39' ' ' THR . 70.3 t -75.41 -50.42 24.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.252 -0.905 . . . . 0.0 110.124 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.6 -28.78 70.13 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.253 -0.904 . . . . 0.0 110.445 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -77.57 -63.37 1.39 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.224 -0.922 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.458 ' CD2' ' HB2' ' A' ' 34' ' ' ALA . 19.0 m-85 -58.38 -43.83 88.63 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.503 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.403 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 64.5 m -57.55 -46.2 84.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 0.0 110.359 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.14 -21.54 61.44 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.201 -0.937 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -77.52 -20.11 54.75 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.348 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.48 -22.78 43.62 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.225 -0.922 . . . . 0.0 109.763 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.69 -19.54 52.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.262 -0.899 . . . . 0.0 110.17 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.37 -57.33 2.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.19 -0.944 . . . . 0.0 110.396 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -48.11 -27.9 2.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.534 -0.729 . . . . 0.0 110.869 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.087 -0.958 . . . . 0.0 110.197 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.9 t60 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.288 0.566 . . . . 0.0 110.08 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -43.89 0.75 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.344 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 153.02 170.75 19.65 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -148.42 85.23 1.51 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -1.131 . . . . 0.0 110.236 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.46 62.36 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -109.23 41.14 1.69 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 110.243 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.8 mm -129.54 84.57 61.29 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 0.0 110.084 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -72.05 114.32 3.94 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.781 1.411 . . . . 0.0 110.456 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.66 162.79 40.32 Favored 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 123.598 1.315 . . . . 0.0 110.453 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.47 -29.52 9.53 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.78 -38.73 92.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.235 -1.156 . . . . 0.0 110.146 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 48.4 m -57.75 -56.38 22.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.55 -50.38 53.57 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.439 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.54 -55.52 28.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.46 -51.78 67.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.92 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.64 -30.41 31.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.003 -1.06 . . . . 0.0 109.648 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.47 -56.81 23.2 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -47.65 -38.17 14.33 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.485 -1.009 . . . . 0.0 110.338 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.1 m -64.63 -34.18 77.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.43 -0.793 . . . . 0.0 109.844 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.34 -27.09 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.364 -0.835 . . . . 0.0 110.358 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.84 -59.25 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.089 -1.007 . . . . 0.0 108.99 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 43.5 t -55.03 -32.01 26.37 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.827 -0.546 . . . . 0.0 110.522 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.73 -22.47 31.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.74 -58.58 2.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.456 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.44 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -82.92 -22.22 33.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.19 -0.944 . . . . 0.0 110.571 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.8 77.42 0.44 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.106 -0.996 . . . . 0.0 110.004 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -70.52 153.78 65.18 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.672 1.354 . . . . 0.0 110.574 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.82 -28.14 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.701 1.369 . . . . 0.0 110.441 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.96 125.28 12.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.347 -0.845 . . . . 0.0 110.15 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.82 -31.38 56.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.292 -0.88 . . . . 0.0 109.989 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.8 t -54.3 -61.17 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 109.859 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.24 -45.69 83.61 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.964 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 25' ' ' GLN . 49.4 t80 -58.15 -47.4 83.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 109.87 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.52 -34.98 52.25 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.373 -0.83 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.421 HG23 ' N ' ' B' ' 39' ' ' THR . 94.0 t -80.85 -52.46 14.17 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 121.19 -0.944 . . . . 0.0 110.14 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.85 -40.31 66.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.314 -0.866 . . . . 0.0 110.554 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -70.38 -68.22 0.44 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.979 . . . . 0.0 110.347 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -50.47 -42.42 54.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.549 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.4 m -58.7 -35.72 73.09 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.103 -0.998 . . . . 0.0 109.855 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.44 -42.22 87.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.292 -0.88 . . . . 0.0 109.952 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 20.1 mt -59.21 -35.55 73.81 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.287 -0.883 . . . . 0.0 109.982 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mmm-85 -56.13 -38.42 70.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.43 -0.794 . . . . 0.0 110.066 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -15.09 61.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.313 -0.867 . . . . 0.0 110.546 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -90.09 -63.21 1.31 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.057 -1.027 . . . . 0.0 110.497 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -47.79 136.42 10.82 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.517 -0.74 . . . . 0.0 110.886 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.189 -179.876 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 33.0 t60 . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.237 0.541 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.88 -43.98 0.73 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.281 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 153.06 170.87 19.81 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 67.8 m-70 -148.43 85.34 1.51 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.56 62.25 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.137 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -109.17 41.12 1.69 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 110.259 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 46.6 mm -129.42 84.46 61.96 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 110.105 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.86 114.41 3.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.666 1.35 . . . . 0.0 110.535 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.78 162.64 40.63 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.534 1.281 . . . . 0.0 110.43 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.68 -29.58 9.58 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.84 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -1.134 . . . . 0.0 110.151 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 47.5 m -57.67 -56.7 18.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.299 -0.876 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.3 -50.56 50.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.336 -0.852 . . . . 0.0 110.418 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 7.8 tp -54.59 -55.35 30.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.878 . . . . 0.0 110.311 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.54 -51.81 67.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.269 -0.894 . . . . 0.0 110.264 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.61 -30.57 32.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.112 -0.992 . . . . 0.0 109.654 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.27 -56.77 23.4 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 108.806 -1.717 . . . . 0.0 108.806 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -47.81 -38.04 14.97 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.365 -1.079 . . . . 0.0 110.322 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.77 -33.88 77.03 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.389 -0.819 . . . . 0.0 109.838 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.63 -26.91 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.34 -0.85 . . . . 0.0 110.415 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.0 -59.37 2.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.948 . . . . 0.0 108.897 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 43.8 t -54.91 -32.16 26.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.83 -0.543 . . . . 0.0 110.528 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.51 -22.58 32.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.089 -1.007 . . . . 0.0 110.363 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.61 -58.6 2.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.391 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.431 ' OE1' ' CZ ' ' B' ' 33' ' ' PHE . 0.0 OUTLIER -82.98 -22.29 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.59 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.89 77.44 0.44 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.117 -0.99 . . . . 0.0 109.971 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -70.66 153.83 64.54 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.717 1.377 . . . . 0.0 110.534 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.85 -28.16 20.34 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 O-C-N 123.838 1.441 . . . . 0.0 110.443 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.98 125.14 12.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.169 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.68 -31.39 57.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.878 . . . . 0.0 110.025 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.9 t -54.22 -61.3 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.303 -0.873 . . . . 0.0 109.789 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -65.21 -45.45 84.66 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.431 ' CZ ' ' OE1' ' B' ' 25' ' ' GLN . 49.4 t80 -58.41 -47.41 84.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.849 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.38 -35.05 50.57 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.361 -0.837 . . . . 0.0 110.23 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 94.8 t -80.79 -52.64 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.64 -40.41 65.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -70.23 -68.41 0.42 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.071 -1.018 . . . . 0.0 110.294 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -50.47 -42.31 54.21 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.421 ' N ' HG23 ' A' ' 35' ' ' VAL . 54.9 m -58.61 -35.86 73.12 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.143 -0.973 . . . . 0.0 109.907 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -42.26 88.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 109.945 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 20.2 mt -59.26 -35.45 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.302 -0.874 . . . . 0.0 109.953 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.7 mmm-85 -56.14 -38.5 70.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.321 -0.862 . . . . 0.0 110.134 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.77 -15.18 61.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.484 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -89.95 -63.3 1.3 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.086 -1.009 . . . . 0.0 110.512 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -47.67 136.57 10.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.575 -0.703 . . . . 0.0 110.802 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.315 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.7 m80 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.287 0.565 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 mtt -99.0 108.17 20.78 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.257 -0.902 . . . . 0.0 110.134 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.4 -164.04 29.87 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -147.55 140.26 24.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.256 -1.143 . . . . 0.0 110.182 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 47.3 mm -101.75 154.49 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 177.98 6.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.201 -0.937 . . . . 0.0 110.302 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.5 mm -74.84 136.19 73.86 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.299 -0.876 . . . . 0.0 109.835 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.42 137.95 31.76 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.527 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.43 167.45 26.96 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.61 1.321 . . . . 0.0 110.388 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.35 -38.82 2.98 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -75.09 -19.34 60.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -1.168 . . . . 0.0 110.325 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.7 m -69.96 -54.85 11.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.216 -0.928 . . . . 0.0 110.341 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -54.22 -37.12 64.23 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.327 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.5 mt -63.06 -59.35 4.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.197 -0.939 . . . . 0.0 110.289 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.31 -48.81 80.22 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.353 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.32 -38.64 63.38 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.188 -0.945 . . . . 0.0 109.92 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.83 -52.8 48.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.33 -47.74 36.7 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.388 -1.066 . . . . 0.0 110.094 179.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.8 -40.93 56.65 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.387 -0.821 . . . . 0.0 110.471 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -76.97 -25.29 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.219 -0.926 . . . . 0.0 110.822 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.3 -59.08 2.39 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.07 -1.019 . . . . 0.0 109.241 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 44.1 t -52.31 -26.71 9.45 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.3 tp -85.41 -38.13 19.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.093 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -53.52 5.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.205 -0.935 . . . . 0.0 110.082 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -61.64 -41.38 97.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 110.104 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 50.03 56.24 17.45 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.337 -0.852 . . . . 0.0 110.375 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.39 155.81 59.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.623 1.328 . . . . 0.0 110.419 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.5 -21.53 25.88 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 O-C-N 123.706 1.372 . . . . 0.0 110.524 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.67 119.48 15.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.281 -0.887 . . . . 0.0 110.321 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.96 -30.23 35.21 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.337 -0.852 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.2 t -51.51 -66.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.187 -0.946 . . . . 0.0 110.063 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.404 ' OD1' ' NH1' ' B' ' 42' ' ' ARG . 1.1 t70 -55.39 -42.76 74.45 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.363 -0.835 . . . . 0.0 109.971 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -58.31 -50.25 74.3 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.826 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB2' ' CG ' ' B' ' 38' ' ' PHE . . . -53.15 -40.55 64.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.352 -0.843 . . . . 0.0 110.366 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.6 t -74.04 -46.12 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.179 -0.951 . . . . 0.0 110.26 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.44 -24.22 67.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -73.36 -68.13 0.52 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.233 -0.917 . . . . 0.0 110.391 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.446 ' CG ' ' HB2' ' B' ' 34' ' ' ALA . 29.9 m-85 -59.33 -50.78 72.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.944 . . . . 0.0 110.389 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.8 m -49.97 -33.77 18.81 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.12 -0.988 . . . . 0.0 110.235 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -75.39 -25.28 57.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -38.28 90.2 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' NH1' ' OD1' ' B' ' 32' ' ' ASP . 0.0 OUTLIER -50.54 -40.01 50.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 179.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -76.48 -25.29 54.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 110.121 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.12 -67.37 0.58 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.245 -0.909 . . . . 0.0 110.19 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -50.88 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.556 -0.715 . . . . 0.0 110.526 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 mtp180 . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.177 179.756 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 2.8 m80 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.248 0.547 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.7 mtt -98.8 107.94 20.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.855 . . . . 0.0 110.178 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.06 -164.31 29.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -147.46 140.18 24.83 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.299 -1.118 . . . . 0.0 110.163 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 47.2 mm -101.74 154.49 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.253 -0.904 . . . . 0.0 110.143 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.83 178.04 6.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.189 -0.944 . . . . 0.0 110.285 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -74.83 136.28 73.86 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.229 -0.919 . . . . 0.0 109.888 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.5 137.88 31.38 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.532 1.28 . . . . 0.0 110.417 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.43 167.52 26.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.632 1.333 . . . . 0.0 110.51 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.29 -38.84 2.96 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -74.97 -19.69 59.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -1.144 . . . . 0.0 110.301 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 74.9 m -69.56 -54.87 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 110.37 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.29 -37.07 64.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.332 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.01 -59.57 4.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.291 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.2 -48.66 80.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 110.283 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -53.36 -38.88 63.71 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.019 -1.05 . . . . 0.0 109.916 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.42 -53.15 45.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 108.86 -1.696 . . . . 0.0 108.86 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.12 -47.68 34.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.405 -1.056 . . . . 0.0 110.146 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.9 -40.82 57.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.518 -0.739 . . . . 0.0 110.513 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -77.14 -25.2 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.185 -0.947 . . . . 0.0 110.676 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.42 -58.86 2.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.105 -0.997 . . . . 0.0 109.265 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 44.4 t -52.51 -26.64 10.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 121.729 -0.607 . . . . 0.0 110.214 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -85.47 -38.17 18.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.26 -0.9 . . . . 0.0 110.056 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.82 -53.53 5.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.177 -0.952 . . . . 0.0 110.023 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -61.6 -41.63 97.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 109.991 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 50.27 56.19 17.29 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.367 -0.833 . . . . 0.0 110.346 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 155.9 58.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 O-C-N 123.713 1.375 . . . . 0.0 110.459 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.46 -21.51 26.01 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.721 1.379 . . . . 0.0 110.6 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.7 119.35 15.02 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.179 -0.951 . . . . 0.0 110.305 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.93 -30.15 35.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.147 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -51.58 -65.99 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . 0.406 ' OD1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 t70 -55.35 -42.94 74.53 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.444 -0.785 . . . . 0.0 109.941 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -58.13 -50.36 73.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.242 -0.911 . . . . 0.0 109.897 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.446 ' HB2' ' CG ' ' A' ' 38' ' ' PHE . . . -53.24 -40.29 64.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.396 -0.815 . . . . 0.0 110.426 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 93.3 t -74.08 -46.23 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.35 -24.27 67.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.172 -0.955 . . . . 0.0 110.294 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -73.29 -67.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.427 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.411 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 29.2 m-85 -59.68 -50.46 73.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.267 -0.895 . . . . 0.0 110.443 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 98.8 m -50.15 -33.83 20.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.074 -1.016 . . . . 0.0 110.205 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -75.27 -25.27 57.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.219 -0.925 . . . . 0.0 109.79 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -38.01 89.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.327 -0.858 . . . . 0.0 109.803 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH1' ' OD1' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -50.88 -39.9 55.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.362 -0.836 . . . . 0.0 110.155 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -76.54 -25.19 53.84 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.35 -0.843 . . . . 0.0 110.234 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.13 -67.22 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.251 -0.906 . . . . 0.0 110.259 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -51.0 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.473 -0.767 . . . . 0.0 110.423 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.13 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.0 m-70 . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.281 0.562 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 38.9 ttm -81.63 -27.22 34.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.94 -149.62 6.07 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.2 p-80 -155.85 37.2 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.243 -1.151 . . . . 0.0 110.186 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -113.14 134.01 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.327 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.33 53.48 0.55 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.268 -0.895 . . . . 0.0 110.175 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -122.94 94.86 46.91 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.151 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.17 139.38 29.37 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.569 1.299 . . . . 0.0 110.407 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.84 -169.63 0.58 Allowed 'Trans proline' 0 C--N 1.312 -1.381 0 O-C-N 123.528 1.278 . . . . 0.0 110.524 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.53 -43.74 1.77 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.36 -27.26 61.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.191 -1.182 . . . . 0.0 110.29 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 41.2 m -65.22 -47.29 77.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.238 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -57.63 -33.81 68.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 -58.78 4.27 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 73.4 mt -56.55 -41.58 77.11 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.213 -0.929 . . . . 0.0 109.774 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -41.06 59.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.185 -0.947 . . . . 0.0 109.779 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.61 -61.35 7.58 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.432 ' CE1' ' CE2' ' A' ' 33' ' ' PHE . 2.2 t80 -48.64 -47.73 40.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.459 -1.024 . . . . 0.0 110.506 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.1 -54.41 25.24 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.092 -1.005 . . . . 0.0 108.879 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.29 -44.86 99.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -51.27 -65.07 0.62 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-O 121.478 0.656 . . . . 0.0 110.685 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 t -54.95 -29.29 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.591 -0.693 . . . . 0.0 110.341 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.71 -25.57 61.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.087 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.427 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -104.49 -50.47 3.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.227 -0.921 . . . . 0.0 109.996 179.818 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.419 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -86.34 50.85 2.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.326 -0.859 . . . . 0.0 110.452 -179.893 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.35 96.09 0.11 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.826 -0.546 . . . . 0.0 111.121 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 48.2 Cg_endo -89.92 153.42 4.93 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 124.004 1.529 . . . . 0.0 110.804 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.06 -27.93 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.694 1.365 . . . . 0.0 109.812 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.44 115.8 11.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.488 -0.758 . . . . 0.0 109.839 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.72 -38.26 83.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.261 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.8 t -53.6 -65.72 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.174 -0.954 . . . . 0.0 109.866 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -56.98 -34.73 68.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.359 -0.838 . . . . 0.0 109.964 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.432 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 64.9 t80 -66.75 -44.32 81.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 0.0 109.675 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.43 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -62.55 -30.56 71.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.314 -0.866 . . . . 0.0 109.958 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.8 t -76.55 -48.41 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.337 -0.852 . . . . 0.0 110.165 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.18 -26.3 64.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.477 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -78.25 -68.47 0.64 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.127 -0.983 . . . . 0.0 110.525 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.436 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 20.9 m-85 -56.93 -45.3 82.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.237 -0.915 . . . . 0.0 110.528 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.7 m -53.55 -43.98 68.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.082 -1.011 . . . . 0.0 110.024 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -66.12 -32.08 73.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.323 -0.861 . . . . 0.0 110.116 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -64.9 -40.07 94.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.025 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -39.42 90.16 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -76.72 -21.98 54.52 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.336 -0.852 . . . . 0.0 110.296 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.3 -65.79 0.64 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.233 -0.917 . . . . 0.0 110.335 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -48.82 129.19 16.74 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.462 -0.774 . . . . 0.0 110.719 -179.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.291 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 30.8 m-70 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.283 0.564 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 38.7 ttm -81.74 -27.18 33.99 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.905 . . . . 0.0 110.17 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.92 -149.58 6.05 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 37.7 p-80 -155.89 36.98 0.35 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -1.147 . . . . 0.0 110.101 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -112.81 133.97 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.862 . . . . 0.0 110.433 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -156.35 53.43 0.55 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.303 -0.873 . . . . 0.0 110.287 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -122.83 94.81 47.07 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.268 -0.895 . . . . 0.0 110.206 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.16 139.32 29.32 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.662 1.348 . . . . 0.0 110.336 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.87 -169.53 0.57 Allowed 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.575 1.303 . . . . 0.0 110.478 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.34 -43.55 1.81 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.34 -27.28 61.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.229 -1.16 . . . . 0.0 110.299 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 39.9 m -65.22 -47.38 77.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.281 -0.887 . . . . 0.0 110.267 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -57.55 -33.93 68.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.86 -59.04 3.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 110.08 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -56.28 -41.68 76.26 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 109.801 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -40.93 59.74 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.077 -1.014 . . . . 0.0 109.891 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.55 -61.47 7.44 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.44 ' CE1' ' CE2' ' B' ' 33' ' ' PHE . 2.2 t80 -48.63 -47.83 39.93 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.392 -1.064 . . . . 0.0 110.517 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.02 -54.5 24.02 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.147 -0.971 . . . . 0.0 108.886 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.19 -44.71 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.401 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.2 OUTLIER -51.43 -64.98 0.64 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.564 0.697 . . . . 0.0 110.707 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 21.1 t -54.99 -29.39 21.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.424 -0.798 . . . . 0.0 110.296 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -25.52 61.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.161 -0.962 . . . . 0.0 110.089 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.421 ' N ' ' HD2' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -104.62 -50.55 3.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.957 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.429 ' O ' ' HD3' ' B' ' 27' ' ' PRO . 0.2 OUTLIER -86.28 50.75 2.05 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.37 -0.831 . . . . 0.0 110.468 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.25 95.98 0.1 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.83 -0.543 . . . . 0.0 111.14 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.429 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 48.3 Cg_endo -89.86 153.48 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 124.014 1.534 . . . . 0.0 110.803 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.04 -28.12 19.58 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.733 1.386 . . . . 0.0 109.88 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.21 115.85 12.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.433 -0.792 . . . . 0.0 109.778 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.66 -38.34 83.64 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.4 t -53.63 -65.6 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -0.959 . . . . 0.0 109.929 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.08 -34.58 68.45 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.507 -0.745 . . . . 0.0 109.983 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.44 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 65.5 t80 -66.98 -43.85 81.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.436 ' HB2' ' CD2' ' A' ' 38' ' ' PHE . . . -62.89 -30.54 71.61 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.32 -0.862 . . . . 0.0 109.948 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.409 ' O ' ' CB ' ' B' ' 39' ' ' THR . 87.8 t -76.43 -48.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.368 -0.833 . . . . 0.0 110.178 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -59.11 -26.4 64.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 110.473 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -78.12 -68.17 0.66 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.588 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -57.29 -45.43 84.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.206 -0.933 . . . . 0.0 110.426 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.409 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 99.7 m -53.43 -43.85 68.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.099 -1.001 . . . . 0.0 110.079 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -66.23 -31.98 73.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.091 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.03 -39.86 94.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.251 -0.906 . . . . 0.0 110.038 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -39.51 90.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 110.151 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -76.66 -21.9 54.78 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.265 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.4 -65.52 0.68 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.247 -0.908 . . . . 0.0 110.37 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.15 129.25 17.72 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.514 -0.741 . . . . 0.0 110.657 -179.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 118.072 -0.966 . . . . 0.0 110.148 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 m80 . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.299 0.571 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.9 ptm -141.93 20.54 2.13 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.171 -0.955 . . . . 0.0 110.349 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.11 145.87 12.14 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.4 m80 -128.1 159.43 35.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.184 -1.186 . . . . 0.0 110.307 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.418 ' N ' ' CD1' ' A' ' 5' ' ' ILE . 5.3 mp -113.69 95.51 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.205 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.1 171.07 16.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.279 -0.888 . . . . 0.0 110.303 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.3 117.49 68.85 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.03 147.05 48.22 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.484 1.255 . . . . 0.0 110.515 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.07 143.57 32.65 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 O-C-N 123.778 1.41 . . . . 0.0 110.537 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.51 -20.45 44.41 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.11 -52.98 19.43 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 110.407 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.1 m -60.76 -49.95 75.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.877 . . . . 0.0 110.401 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.67 -45.57 66.84 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.324 -0.86 . . . . 0.0 110.407 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.08 -53.56 55.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.168 -0.957 . . . . 0.0 110.341 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.7 mt -62.73 -47.82 81.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.21 -0.931 . . . . 0.0 110.08 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.58 -34.55 58.75 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.236 -0.915 . . . . 0.0 109.719 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.77 -55.28 30.85 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -47.39 -43.66 23.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.504 -0.998 . . . . 0.0 110.404 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.4 m -55.9 -36.12 67.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.431 -0.793 . . . . 0.0 110.265 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.7 t -82.41 -25.35 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 110.543 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -85.32 -54.12 4.8 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.13 -0.981 . . . . 0.0 108.886 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.9 t -53.75 -39.15 37.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 CA-C-O 121.219 0.533 . . . . 0.0 110.308 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.99 -40.4 71.88 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -65.42 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.236 -0.915 . . . . 0.0 110.242 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.13 65.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.177 -0.952 . . . . 0.0 110.081 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.96 58.58 16.81 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.318 -0.864 . . . . 0.0 110.566 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.54 146.89 50.63 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.627 1.33 . . . . 0.0 110.303 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.66 -30.77 17.6 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.63 1.332 . . . . 0.0 110.536 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -133.6 121.21 21.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 110.241 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.5 -25.04 41.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.065 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.0 t -54.34 -53.71 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.211 -0.931 . . . . 0.0 109.793 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.38 -47.44 60.9 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.584 -0.697 . . . . 0.0 109.934 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -58.13 -50.51 73.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.224 -0.922 . . . . 0.0 109.577 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.78 -37.35 63.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.306 -0.871 . . . . 0.0 109.921 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 68.8 t -79.31 -34.89 16.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.34 -0.85 . . . . 0.0 109.915 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.76 -22.75 49.76 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -79.76 -64.01 1.28 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.176 -0.952 . . . . 0.0 110.623 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -59.43 -48.07 83.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.198 -0.939 . . . . 0.0 110.533 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.408 ' N ' HG23 ' B' ' 35' ' ' VAL . 62.3 m -52.48 -50.57 62.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.041 -1.037 . . . . 0.0 110.052 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -58.79 -26.7 64.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.157 -0.965 . . . . 0.0 109.832 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -61.63 -40.9 96.5 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.4 -0.813 . . . . 0.0 110.12 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.55 -63.06 1.26 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -62.45 -19.97 64.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.907 . . . . 0.0 110.241 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.7 -59.19 3.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.452 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -39.38 21.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.473 -0.767 . . . . 0.0 110.926 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.231 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 m80 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.18 0.514 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 23.9 ptm -141.74 20.54 2.16 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.449 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.01 145.76 12.01 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 15.6 m80 -128.02 159.27 35.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.26 -1.141 . . . . 0.0 110.346 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.414 ' N ' ' CD1' ' B' ' 5' ' ' ILE . 5.3 mp -113.53 95.39 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -0.895 . . . . 0.0 110.206 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -147.89 171.29 15.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.168 -0.958 . . . . 0.0 110.284 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.43 117.4 68.63 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.204 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.95 147.2 48.97 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.5 1.263 . . . . 0.0 110.429 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.21 143.56 32.08 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.693 1.364 . . . . 0.0 110.503 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.65 -20.59 43.6 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 tp -70.16 -52.81 20.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.093 -1.24 . . . . 0.0 110.422 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 85.7 m -60.86 -49.83 75.88 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.167 -0.958 . . . . 0.0 110.308 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.79 -45.54 67.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.0 110.37 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.1 -53.73 53.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.294 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 66.4 mt -62.63 -47.89 81.77 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.912 . . . . 0.0 110.022 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.55 -34.63 58.92 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.15 -0.969 . . . . 0.0 109.659 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.69 -55.29 30.74 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.85 -1.7 . . . . 0.0 108.85 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -47.43 -43.56 23.95 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.375 -1.074 . . . . 0.0 110.336 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.4 m -56.09 -35.92 67.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.531 -0.731 . . . . 0.0 110.254 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.46 -25.53 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.26 -0.9 . . . . 0.0 110.476 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -85.22 -54.06 4.85 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 108.877 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 95.6 t -53.82 -39.04 37.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.859 -0.526 . . . . 0.0 110.249 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 12.2 mt -71.1 -40.53 71.45 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.235 -0.915 . . . . 0.0 110.146 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.04 -65.48 0.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 110.266 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.26 -31.09 65.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.203 -0.936 . . . . 0.0 110.015 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.93 58.56 16.83 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.525 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.37 146.96 51.73 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.691 1.364 . . . . 0.0 110.339 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.71 -31.01 17.04 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.685 1.361 . . . . 0.0 110.52 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -133.43 121.34 22.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.274 -0.891 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.52 -25.16 41.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 110.067 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 41.6 t -54.22 -53.73 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.768 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.42 -47.37 61.05 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.598 -0.689 . . . . 0.0 109.952 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -58.2 -50.33 73.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 109.619 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.87 -37.51 63.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.345 -0.847 . . . . 0.0 109.881 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.408 HG23 ' N ' ' A' ' 39' ' ' THR . 72.2 t -79.13 -34.78 16.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 O-C-N 121.341 -0.85 . . . . 0.0 110.019 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.94 -22.64 49.23 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.314 -0.866 . . . . 0.0 109.669 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -79.75 -64.24 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.218 -0.926 . . . . 0.0 110.586 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -59.21 -47.98 83.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.184 -0.947 . . . . 0.0 110.683 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 61.0 m -52.76 -50.37 63.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.956 -1.09 . . . . 0.0 110.051 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -59.0 -26.65 64.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.857 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -61.67 -40.87 96.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 110.04 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.45 -63.21 1.22 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.283 -0.886 . . . . 0.0 110.193 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -62.29 -20.15 64.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.51 -59.31 3.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.197 -0.939 . . . . 0.0 110.435 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.37 -39.23 21.55 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.517 -0.74 . . . . 0.0 110.906 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.253 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.7 p-80 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.194 0.521 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 14.3 ttp -73.68 108.65 6.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.178 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.97 165.47 16.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.12 176.32 7.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.304 -1.115 . . . . 0.0 110.261 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.457 ' N ' ' CD1' ' A' ' 5' ' ' ILE . 4.7 mp -109.14 110.33 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.235 -0.916 . . . . 0.0 110.251 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -113.85 83.95 1.95 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.868 . . . . 0.0 110.167 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -65.72 147.82 98.52 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.919 . . . . 0.0 110.183 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.01 119.25 6.06 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.732 1.385 . . . . 0.0 110.495 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.11 158.73 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.529 1.278 . . . . 0.0 110.362 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.17 -35.51 4.98 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.16 -29.16 70.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 110.214 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.9 m -56.77 -45.73 81.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.9 . . . . 0.0 110.123 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 -36.92 79.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -0.846 . . . . 0.0 110.366 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.33 -47.9 53.72 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.2 -0.938 . . . . 0.0 110.232 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -58.2 6.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.075 -1.015 . . . . 0.0 110.102 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.4 -24.69 5.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.155 -0.966 . . . . 0.0 109.903 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.94 -57.41 10.89 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.417 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.1 t80 -48.54 -35.8 14.07 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.384 -1.068 . . . . 0.0 110.312 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.01 -39.17 93.96 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.42 -0.8 . . . . 0.0 110.065 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.423 ' O ' ' CB ' ' A' ' 24' ' ' ARG . 92.2 t -80.88 -21.52 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 110.798 -179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.95 -55.05 4.01 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.065 -1.022 . . . . 0.0 109.333 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.0 t -56.85 -31.18 35.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.722 -0.611 . . . . 0.0 110.389 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 mt -87.43 -42.0 13.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.218 -0.926 . . . . 0.0 110.34 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -71.9 -53.27 13.69 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.143 -0.973 . . . . 0.0 110.262 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.31 -35.35 63.66 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.191 -0.943 . . . . 0.0 109.855 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.3 64.07 8.97 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.476 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.39 151.29 65.38 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.741 1.39 . . . . 0.0 110.527 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.36 -22.52 25.05 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.733 1.386 . . . . 0.0 110.272 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.73 116.31 14.75 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.261 -0.9 . . . . 0.0 110.13 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.5 tp -80.53 -34.2 35.73 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 110.307 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.4 t -51.67 -66.21 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.208 -0.932 . . . . 0.0 110.142 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.15 -40.5 67.49 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.428 -0.795 . . . . 0.0 109.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.9 -54.98 38.44 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.36 -0.838 . . . . 0.0 109.763 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.417 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -53.0 -38.55 62.4 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.429 HG21 ' N ' ' B' ' 39' ' ' THR . 81.6 t -77.37 -27.09 15.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.293 -0.879 . . . . 0.0 109.837 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.99 -51.94 7.54 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.334 -0.854 . . . . 0.0 109.868 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -56.71 -63.17 1.29 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 110.786 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -53.89 -52.31 60.93 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 111.008 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.441 ' N ' HG21 ' B' ' 35' ' ' VAL . 22.3 m -53.36 -24.93 13.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.933 -1.104 . . . . 0.0 110.086 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -25.56 43.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.929 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.6 -25.35 60.29 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.04 -29.1 64.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.262 -0.899 . . . . 0.0 109.629 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -66.43 -35.28 79.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.32 -0.862 . . . . 0.0 110.184 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.11 -65.41 0.69 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.251 -0.906 . . . . 0.0 110.323 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -49.73 -71.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.611 -0.681 . . . . 0.0 110.686 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.293 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.234 0.54 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 14.1 ttp -73.71 108.46 6.57 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.209 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.74 165.5 16.53 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.25 176.23 7.84 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -1.153 . . . . 0.0 110.279 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.457 ' N ' ' CD1' ' B' ' 5' ' ' ILE . 4.7 mp -109.05 110.26 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.303 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -113.73 83.75 1.91 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 110.21 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 pp -65.69 147.87 98.48 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.204 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.02 119.28 6.08 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.705 1.371 . . . . 0.0 110.393 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.18 158.79 53.93 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.49 1.258 . . . . 0.0 110.38 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.19 -35.45 5.02 Favored Glycine 0 N--CA 1.489 2.17 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.1 -29.32 70.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -1.148 . . . . 0.0 110.212 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 93.9 m -56.66 -45.68 81.5 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.249 -0.907 . . . . 0.0 110.239 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -36.79 79.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.364 -0.835 . . . . 0.0 110.281 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.53 -47.79 52.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.273 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.27 -58.2 6.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 110.214 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.52 -24.65 5.45 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.21 -0.931 . . . . 0.0 109.858 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.81 -57.61 10.67 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.427 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.1 t80 -48.44 -35.85 13.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.423 -1.045 . . . . 0.0 110.394 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.02 -39.19 94.02 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.479 -0.763 . . . . 0.0 110.039 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' B' ' 24' ' ' ARG . 92.9 t -80.76 -21.57 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.952 . . . . 0.0 110.825 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.97 -55.14 3.96 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.014 -1.053 . . . . 0.0 109.269 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 29.1 t -56.79 -31.07 34.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.716 -0.615 . . . . 0.0 110.475 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.51 -42.14 12.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.0 110.29 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.419 ' CB ' ' O ' ' B' ' 20' ' ' VAL . 0.2 OUTLIER -71.88 -53.2 13.93 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 110.241 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.29 -35.4 63.72 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.202 -0.936 . . . . 0.0 109.763 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.28 64.14 8.86 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.323 -0.861 . . . . 0.0 110.441 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.56 151.32 64.42 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.675 1.355 . . . . 0.0 110.449 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.41 -22.36 25.08 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.714 1.376 . . . . 0.0 110.313 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.81 116.4 14.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 110.067 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 tp -80.67 -34.32 34.89 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.365 -0.835 . . . . 0.0 110.261 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.5 t -51.59 -66.33 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.271 -0.893 . . . . 0.0 110.038 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.03 -40.57 67.19 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.543 -0.723 . . . . 0.0 109.831 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -60.79 -55.09 37.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.409 -0.807 . . . . 0.0 109.688 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.427 ' CA ' ' OH ' ' B' ' 18' ' ' TYR . . . -52.96 -38.25 61.89 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.395 -0.816 . . . . 0.0 109.997 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.441 HG21 ' N ' ' A' ' 39' ' ' THR . 81.1 t -77.73 -26.76 15.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 O-C-N 121.248 -0.907 . . . . 0.0 109.838 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -82.3 -51.96 7.39 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.275 -0.891 . . . . 0.0 109.772 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -56.85 -63.01 1.35 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 0.0 110.715 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -54.15 -52.1 62.2 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.926 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.429 ' N ' HG21 ' A' ' 35' ' ' VAL . 22.4 m -53.37 -25.2 14.49 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.08 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -25.91 43.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 109.84 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.14 -25.41 60.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.242 -0.911 . . . . 0.0 110.03 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -28.99 64.73 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.371 -0.83 . . . . 0.0 109.672 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.43 -35.23 79.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.199 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.3 -65.24 0.71 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.321 -0.862 . . . . 0.0 110.291 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -49.97 -71.22 0.07 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.492 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.098 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.6 ttt 53.11 76.73 0.19 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.311 -0.868 . . . . 0.0 110.217 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.82 105.78 0.2 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -128.02 -70.27 0.7 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.232 -1.158 . . . . 0.0 110.329 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.1 tp -112.58 142.53 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 110.386 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -167.42 60.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.403 -0.811 . . . . 0.0 110.103 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -126.9 158.0 69.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.933 . . . . 0.0 110.259 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.35 115.99 4.54 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 O-C-N 123.82 1.432 . . . . 0.0 110.54 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.13 151.58 49.7 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.521 1.274 . . . . 0.0 110.319 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.03 -32.23 4.84 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.54 -27.1 60.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.257 -1.143 . . . . 0.0 110.239 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.09 -61.64 2.31 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.57 -48.37 57.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 0.0 110.371 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.68 -57.91 10.01 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.291 -0.88 . . . . 0.0 110.153 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -60.69 -38.55 85.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -42.85 69.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.091 -1.005 . . . . 0.0 109.754 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.417 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -56.49 -56.23 25.58 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.844 -1.702 . . . . 0.0 108.844 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.422 ' OH ' ' CB ' ' A' ' 34' ' ' ALA . 1.4 t80 -47.09 -45.86 22.31 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.467 -1.019 . . . . 0.0 110.423 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -61.22 -32.89 72.67 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -0.767 . . . . 0.0 109.86 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.0 t -82.72 -26.99 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.871 . . . . 0.0 110.664 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -80.12 -59.21 2.8 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.089 -1.007 . . . . 0.0 109.016 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 26' ' ' GLN . 20.7 t -54.93 -32.94 27.51 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.883 -0.511 . . . . 0.0 109.8 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.26 -19.86 42.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.082 -1.011 . . . . 0.0 110.215 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.15 -49.45 8.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -0.921 . . . . 0.0 110.504 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.431 ' CG ' ' HD3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -99.99 -23.59 14.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.22 -0.925 . . . . 0.0 110.678 -179.693 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.4 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.4 mt-30 49.67 71.04 1.7 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.431 ' HD3' ' CG ' ' A' ' 25' ' ' GLN . 44.6 Cg_endo -71.2 154.09 61.96 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.679 1.357 . . . . 0.0 110.379 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.02 -42.14 3.37 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.358 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -110.16 114.64 28.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.26 -0.9 . . . . 0.0 110.152 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.17 -33.75 22.23 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.866 . . . . 0.0 109.93 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.9 t -52.9 -64.79 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 0.0 109.799 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.532 -0.73 . . . . 0.0 109.828 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -53.96 -47.1 71.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.842 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.452 ' HB2' ' CG ' ' B' ' 38' ' ' PHE . . . -52.34 -46.94 66.3 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.316 -0.865 . . . . 0.0 109.945 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' A' ' 39' ' ' THR . 94.8 t -62.76 -49.12 84.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 O-C-N 121.206 -0.934 . . . . 0.0 109.871 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.42 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -51.28 -56.48 12.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.383 -0.823 . . . . 0.0 110.531 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -53.35 -63.81 1.03 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.424 ' CG ' ' HB2' ' B' ' 34' ' ' ALA . 22.8 m-85 -58.29 -53.45 58.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 110.479 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 90.3 m -51.52 -33.66 32.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.138 -0.976 . . . . 0.0 110.164 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.87 -29.83 44.7 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.0 109.979 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.62 -34.79 69.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 110.086 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -31.5 69.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.262 -0.899 . . . . 0.0 110.162 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -100.03 -30.94 11.69 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.206 -0.934 . . . . 0.0 110.204 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 46' ' ' ARG . . . -60.88 -77.21 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.915 . . . . 0.0 110.26 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.9 -90.74 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.792 -0.568 . . . . 0.0 110.955 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 O-C-N 120.86 -1.15 . . . . 0.0 110.207 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.244 0.545 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 19.6 ttt 53.15 76.58 0.2 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.221 -0.924 . . . . 0.0 110.269 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.95 105.88 0.2 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -128.04 -70.26 0.7 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.245 -1.15 . . . . 0.0 110.35 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.1 tp -112.51 142.52 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.231 -0.918 . . . . 0.0 110.369 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -167.41 60.74 0.08 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.129 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 2.2 pp -126.88 158.04 69.74 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.257 -0.902 . . . . 0.0 110.289 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.35 115.9 4.5 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.789 1.415 . . . . 0.0 110.527 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.01 151.51 50.25 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.471 1.248 . . . . 0.0 110.423 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.96 -32.03 4.92 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.59 -27.08 60.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -1.149 . . . . 0.0 110.19 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.04 -61.88 2.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.226 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.34 -48.32 55.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.824 . . . . 0.0 110.454 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.72 -58.02 9.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.55 -38.44 84.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.307 -0.871 . . . . 0.0 110.314 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.24 -42.81 70.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.059 -1.025 . . . . 0.0 109.76 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . 0.418 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -56.6 -56.16 26.06 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.417 ' OH ' ' CB ' ' B' ' 34' ' ' ALA . 1.4 t80 -47.16 -45.79 23.04 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.519 -0.989 . . . . 0.0 110.4 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -61.33 -32.66 72.54 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.52 -0.737 . . . . 0.0 109.963 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 48.2 t -82.78 -27.1 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 110.599 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' B' ' 17' ' ' GLY . 1.0 OUTLIER -80.06 -59.24 2.79 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.133 -0.979 . . . . 0.0 109.083 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 20.5 t -54.97 -32.71 27.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.801 -0.562 . . . . 0.0 109.857 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.51 -19.79 41.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 0.0 110.134 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -49.48 8.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.252 -0.905 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.431 ' CG ' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -99.98 -23.69 14.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.24 -0.912 . . . . 0.0 110.671 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 49.75 70.97 1.73 Allowed Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.079 -1.013 . . . . 0.0 110.519 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.431 ' HD3' ' CG ' ' B' ' 25' ' ' GLN . 44.4 Cg_endo -71.16 153.93 62.21 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.689 1.363 . . . . 0.0 110.364 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.99 -42.02 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 123.672 1.354 . . . . 0.0 110.299 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -110.36 114.5 28.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.908 . . . . 0.0 110.13 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.99 -33.84 22.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.229 -0.919 . . . . 0.0 109.969 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.0 t -52.82 -64.76 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.327 -0.858 . . . . 0.0 109.837 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.87 -45.86 82.22 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -54.13 -47.2 72.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.245 -0.909 . . . . 0.0 109.807 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.424 ' HB2' ' CG ' ' A' ' 38' ' ' PHE . . . -52.26 -46.83 65.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 0.0 109.969 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' B' ' 39' ' ' THR . 99.3 t -62.96 -49.0 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.278 -0.889 . . . . 0.0 109.873 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.423 ' N ' ' OE1' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -51.32 -56.47 12.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.477 -0.764 . . . . 0.0 110.519 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -53.25 -64.18 0.9 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.0 110.424 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.452 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 23.1 m-85 -58.01 -53.28 60.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.205 -0.935 . . . . 0.0 110.534 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.419 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 89.5 m -51.69 -33.63 34.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.075 -1.016 . . . . 0.0 110.113 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -29.88 44.35 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.273 -0.892 . . . . 0.0 110.024 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.45 -35.06 69.65 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.856 . . . . 0.0 110.071 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.73 -31.63 69.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.264 -0.897 . . . . 0.0 110.14 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -99.98 -30.82 11.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.252 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . 0.442 ' O ' ' N ' ' B' ' 46' ' ' ARG . . . -60.98 -77.23 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.282 -0.886 . . . . 0.0 110.269 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.81 -90.79 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.874 -0.516 . . . . 0.0 110.979 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' B' ' 44' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 120.842 -1.161 . . . . 0.0 110.265 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 m170 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.211 0.529 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.4 mtm 53.32 178.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.301 -0.874 . . . . 0.0 110.26 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.75 112.08 3.46 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.1 t-80 -116.26 48.07 1.31 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -1.171 . . . . 0.0 110.145 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -116.05 75.96 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.262 -0.899 . . . . 0.0 110.368 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -132.44 72.6 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.28 -0.888 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -102.67 132.41 21.32 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.321 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.62 121.24 6.59 Favored 'Trans proline' 0 C--N 1.313 -1.342 0 O-C-N 123.492 1.259 . . . . 0.0 110.197 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.07 162.08 39.65 Favored 'Trans proline' 0 C--N 1.312 -1.366 0 O-C-N 123.424 1.223 . . . . 0.0 110.599 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.87 -33.92 5.57 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -32.47 49.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -1.126 . . . . 0.0 110.371 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -59.47 -56.09 26.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.95 . . . . 0.0 110.261 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -51.93 -30.08 22.95 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.366 -0.834 . . . . 0.0 110.383 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.6 tp -69.85 -56.94 5.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.155 -0.966 . . . . 0.0 110.174 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.84 -46.06 89.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.163 -0.961 . . . . 0.0 110.191 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.76 -33.86 50.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.257 -0.902 . . . . 0.0 109.881 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.16 -57.63 17.53 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.422 ' OH ' ' N ' ' A' ' 34' ' ' ALA . 2.1 t80 -45.13 -35.89 3.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.897 . . . . 0.0 110.711 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 31.9 m -67.98 -35.1 77.79 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.825 . . . . 0.0 109.952 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.43 -24.38 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.218 -0.926 . . . . 0.0 110.4 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -76.9 -56.71 4.36 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.07 -1.019 . . . . 0.0 108.679 179.501 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.0 t -56.35 -35.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 121.188 0.518 . . . . 0.0 110.245 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.426 ' N ' HD21 ' A' ' 23' ' ' LEU . 3.8 mm? -73.73 -23.11 59.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.255 -0.903 . . . . 0.0 110.377 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.17 -65.39 1.02 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.249 -0.907 . . . . 0.0 110.764 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.79 -29.11 55.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.162 -0.961 . . . . 0.0 110.574 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 53.08 76.81 0.49 Allowed Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 0.0 110.055 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.97 156.69 55.93 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.727 1.382 . . . . 0.0 110.558 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.17 -33.5 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.769 1.405 . . . . 0.0 110.404 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -127.86 116.03 19.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.349 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.408 HD22 ' CD2' ' B' ' 14' ' ' LEU . 11.4 tp -74.35 -44.68 51.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.328 -0.858 . . . . 0.0 110.059 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.1 t -50.61 -60.85 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.367 -0.833 . . . . 0.0 109.896 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.86 -37.92 77.59 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.629 -0.669 . . . . 0.0 109.945 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 27.8 t80 -62.57 -51.61 66.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.28 -0.888 . . . . 0.0 109.699 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.422 ' N ' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -36.76 56.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.422 HG23 ' N ' ' B' ' 39' ' ' THR . 97.7 t -73.94 -51.55 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 O-C-N 121.207 -0.933 . . . . 0.0 110.173 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.24 -29.82 69.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.195 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.428 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 74.5 t80 -78.24 -67.39 0.74 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.283 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -51.69 -44.53 63.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.275 -0.89 . . . . 0.0 110.309 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.4 m -54.62 -44.56 73.24 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.724 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -71.49 -27.15 63.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.332 -0.855 . . . . 0.0 109.814 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.856 . . . . 0.0 110.027 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.67 -26.71 60.03 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.284 -0.885 . . . . 0.0 109.848 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -103.77 13.78 32.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 110.485 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.67 -69.59 0.76 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.16 -0.962 . . . . 0.0 110.239 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.14 -55.21 10.88 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.571 -0.705 . . . . 0.0 110.454 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.211 179.897 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 m170 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.22 0.533 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 5.4 mtm 53.38 178.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 110.281 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.88 112.38 3.51 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -116.52 48.02 1.34 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -1.142 . . . . 0.0 110.111 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -115.96 75.71 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 110.441 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -132.14 72.56 1.5 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.221 -0.924 . . . . 0.0 110.044 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -102.65 132.27 21.48 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.351 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.5 121.2 6.6 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 123.519 1.273 . . . . 0.0 110.289 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.1 162.02 39.71 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.441 1.232 . . . . 0.0 110.542 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.85 -33.7 5.73 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.45 -32.48 48.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.201 -1.176 . . . . 0.0 110.41 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.2 m -59.4 -56.17 25.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.167 -0.958 . . . . 0.0 110.327 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.9 -29.86 21.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.321 -0.862 . . . . 0.0 110.463 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.408 ' CD2' HD22 ' A' ' 30' ' ' LEU . 17.5 tp -70.11 -56.79 5.99 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.98 -45.93 90.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.936 . . . . 0.0 110.187 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.79 -34.08 51.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.312 -0.867 . . . . 0.0 109.846 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.25 -57.53 17.9 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.416 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 2.1 t80 -45.01 -36.12 3.28 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.566 -0.961 . . . . 0.0 110.623 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 33.6 m -67.77 -35.14 78.16 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.437 -0.789 . . . . 0.0 110.04 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.45 -24.39 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.236 -0.915 . . . . 0.0 110.399 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.445 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -76.89 -56.65 4.4 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.184 -0.948 . . . . 0.0 108.698 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 46.3 t -56.29 -36.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 121.206 0.526 . . . . 0.0 110.188 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . 0.416 HD21 ' N ' ' B' ' 23' ' ' LEU . 3.8 mm? -73.51 -23.0 59.97 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.32 -65.36 1.02 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.211 -0.931 . . . . 0.0 110.71 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.89 -28.94 55.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.175 -0.953 . . . . 0.0 110.659 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 52.98 76.95 0.48 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.109 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.11 156.68 55.39 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.765 1.403 . . . . 0.0 110.637 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.12 -33.37 11.74 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.779 1.41 . . . . 0.0 110.448 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -128.12 116.12 19.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 110.259 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 tp -74.47 -44.66 50.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.217 -0.927 . . . . 0.0 110.023 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.9 t -50.74 -60.88 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.242 -0.911 . . . . 0.0 109.859 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.61 -37.9 76.84 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.584 -0.698 . . . . 0.0 109.853 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.41 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 27.9 t80 -62.87 -51.35 67.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.304 -0.872 . . . . 0.0 109.654 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.416 ' CA ' ' OH ' ' B' ' 18' ' ' TYR . . . -52.84 -36.5 58.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.001 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 95.6 t -74.18 -51.55 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.262 -0.898 . . . . 0.0 110.059 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.31 -29.39 68.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.253 -0.904 . . . . 0.0 110.377 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.445 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 74.4 t80 -78.53 -67.27 0.76 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.186 -0.946 . . . . 0.0 110.261 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -51.8 -44.54 63.52 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.422 ' N ' HG23 ' A' ' 35' ' ' VAL . 47.1 m -54.5 -44.53 72.79 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.161 -0.962 . . . . 0.0 109.717 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -71.84 -26.81 62.52 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 109.83 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -63.09 -25.26 68.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 110.037 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.84 -26.68 59.87 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 109.744 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -103.74 13.73 32.46 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 110.448 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.68 -69.54 0.76 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.157 -0.964 . . . . 0.0 110.261 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.34 -55.15 11.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.58 -0.7 . . . . 0.0 110.443 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.068 179.828 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.199 0.523 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -160.23 101.01 1.39 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.265 -0.897 . . . . 0.0 110.144 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.17 -134.41 6.28 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -130.74 154.05 48.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.192 -1.181 . . . . 0.0 110.29 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.46 ' N ' ' CD1' ' A' ' 5' ' ' ILE . 5.2 mp -125.96 149.45 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.274 -0.891 . . . . 0.0 110.099 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -121.55 47.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.198 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.2 mm -114.18 124.77 30.28 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.248 -0.907 . . . . 0.0 110.186 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.15 139.53 32.64 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.424 1.223 . . . . 0.0 110.466 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.25 173.84 13.07 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.588 1.31 . . . . 0.0 110.387 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.16 -35.27 4.34 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.7 tt -75.04 -32.33 61.53 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -1.102 . . . . 0.0 110.094 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.2 m -62.67 -49.47 75.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.0 110.126 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -54.75 -49.96 69.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 110.257 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.85 -50.0 70.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.353 -0.842 . . . . 0.0 110.327 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -56.1 -52.44 64.29 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 110.177 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.28 -33.71 43.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.127 -0.983 . . . . 0.0 109.804 179.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.88 -55.45 30.49 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 108.803 -1.719 . . . . 0.0 108.803 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.431 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.0 OUTLIER -49.78 -45.43 49.72 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.366 -1.079 . . . . 0.0 110.396 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 85.3 m -59.08 -35.77 73.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.401 -0.812 . . . . 0.0 110.069 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.4 t -76.66 -27.06 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.484 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -85.23 -64.22 1.19 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.2 -0.937 . . . . 0.0 109.338 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.435 HG21 ' CE2' ' A' ' 33' ' ' PHE . 39.3 t -50.55 -25.76 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.752 -0.592 . . . . 0.0 110.451 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 19' ' ' THR . 19.6 tp -88.36 -25.64 22.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.244 -0.91 . . . . 0.0 110.205 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.64 -56.38 3.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.159 -0.963 . . . . 0.0 110.529 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.452 ' HG3' ' N ' ' A' ' 26' ' ' GLN . 5.9 pt20 -85.32 -27.03 26.19 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.075 -1.016 . . . . 0.0 110.581 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.452 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.3 OUTLIER 47.87 80.68 0.28 Allowed Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 0.0 110.632 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.74 161.66 44.46 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.622 1.327 . . . . 0.0 110.547 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.3 -36.02 7.64 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.736 1.387 . . . . 0.0 110.236 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -130.08 113.8 14.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.308 -0.87 . . . . 0.0 110.001 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.3 tp -67.2 -36.56 81.99 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.0 110.367 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.0 t -51.3 -65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.216 -0.927 . . . . 0.0 110.091 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.409 ' HA ' ' NH1' ' B' ' 42' ' ' ARG . 1.0 OUTLIER -54.24 -40.87 68.14 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.527 -0.733 . . . . 0.0 109.997 179.711 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.435 ' CE2' HG21 ' A' ' 22' ' ' VAL . 66.6 t80 -60.5 -46.71 89.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.771 179.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.431 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.78 -44.44 86.23 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.145 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.0 t -69.91 -34.49 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.301 -0.874 . . . . 0.0 110.021 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.5 40.12 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.279 -0.888 . . . . 0.0 109.751 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 16.1 t80 -76.58 -68.48 0.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.158 -0.964 . . . . 0.0 110.291 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -51.67 -50.31 60.67 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.224 -0.922 . . . . 0.0 110.575 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.8 m -53.14 -39.07 63.24 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.949 -1.094 . . . . 0.0 110.054 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -73.01 -27.21 61.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.33 -0.856 . . . . 0.0 109.989 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.76 -35.47 76.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.358 -0.839 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.1 -38.2 70.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.268 -0.895 . . . . 0.0 110.222 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -71.03 -13.29 61.94 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.223 -0.923 . . . . 0.0 110.576 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.04 -64.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.066 -1.021 . . . . 0.0 110.475 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -47.98 -30.19 4.09 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.454 -0.779 . . . . 0.0 110.844 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.238 179.952 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.256 0.551 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -160.03 101.02 1.42 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.237 -0.914 . . . . 0.0 110.152 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.1 -134.47 6.31 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -130.8 153.85 48.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -1.128 . . . . 0.0 110.287 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.448 ' N ' ' CD1' ' B' ' 5' ' ' ILE . 5.3 mp -125.84 149.45 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.166 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -121.6 47.95 1.77 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.319 -0.863 . . . . 0.0 110.211 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.3 mm -114.26 124.64 30.45 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.19 139.51 32.5 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 123.393 1.207 . . . . 0.0 110.359 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.2 173.66 13.34 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.57 1.3 . . . . 0.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.43 -35.34 4.34 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tt -75.06 -32.32 61.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.326 -1.102 . . . . 0.0 110.113 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.8 m -62.58 -49.5 75.0 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.344 -0.848 . . . . 0.0 110.15 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -54.73 -49.97 69.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.848 . . . . 0.0 110.267 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.84 -50.13 70.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.264 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -56.02 -52.61 63.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -33.99 40.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.11 -0.994 . . . . 0.0 109.856 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.61 -55.6 29.59 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.88 -1.688 . . . . 0.0 108.88 179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.429 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.0 OUTLIER -49.7 -45.53 49.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.417 -1.049 . . . . 0.0 110.395 179.535 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 84.8 m -58.94 -35.63 73.43 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.418 -0.801 . . . . 0.0 110.072 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 83.9 t -76.92 -26.92 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.274 -0.891 . . . . 0.0 110.417 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.444 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -85.29 -64.21 1.19 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.109 -0.995 . . . . 0.0 109.357 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.439 HG21 ' CE2' ' B' ' 33' ' ' PHE . 39.2 t -50.57 -25.68 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.716 -0.615 . . . . 0.0 110.329 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . 0.414 ' CB ' ' O ' ' B' ' 19' ' ' THR . 19.9 tp -88.57 -25.53 22.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.118 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.83 -56.32 3.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.167 -0.958 . . . . 0.0 110.494 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 6.0 pt20 -85.36 -26.94 26.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.153 -0.967 . . . . 0.0 110.596 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.435 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 0.3 OUTLIER 47.86 80.65 0.28 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.177 -0.952 . . . . 0.0 110.524 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.402 ' HD3' ' HG3' ' B' ' 25' ' ' GLN . 45.7 Cg_endo -71.65 161.54 44.94 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.791 1.416 . . . . 0.0 110.567 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -36.09 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.67 1.353 . . . . 0.0 110.212 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -129.86 113.88 15.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -0.894 . . . . 0.0 110.001 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.3 tp -67.21 -36.51 81.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 110.374 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.8 t -51.34 -65.4 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.255 -0.903 . . . . 0.0 110.09 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.52 -40.57 68.73 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.437 -0.79 . . . . 0.0 109.923 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.439 ' CE2' HG21 ' B' ' 22' ' ' VAL . 66.4 t80 -60.55 -47.0 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.22 -0.925 . . . . 0.0 109.755 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.429 ' CA ' ' OH ' ' B' ' 18' ' ' TYR . . . -57.36 -44.46 84.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.264 -0.898 . . . . 0.0 110.252 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 98.1 t -70.06 -34.48 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.204 -0.935 . . . . 0.0 109.987 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.58 40.14 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.359 -0.838 . . . . 0.0 109.748 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.444 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 16.2 t80 -76.42 -68.44 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.981 . . . . 0.0 110.383 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -51.84 -50.2 61.36 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 51.8 m -53.21 -38.99 63.38 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.082 -1.011 . . . . 0.0 110.047 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -73.08 -27.24 61.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.946 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -35.5 76.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.339 -0.851 . . . . 0.0 110.11 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.409 ' NH1' ' HA ' ' A' ' 32' ' ' ASP . 3.4 mtp180 -56.07 -38.34 70.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.174 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.88 -13.32 61.99 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.64 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.11 -64.25 1.1 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.436 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -48.15 -29.86 4.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.499 -0.751 . . . . 0.0 110.753 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.5 mtp180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.22 179.893 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.214 0.53 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mtm -110.39 105.27 14.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.2 -0.937 . . . . 0.0 110.283 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.69 100.63 2.34 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -143.97 152.01 40.5 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.294 -1.121 . . . . 0.0 110.251 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.407 HG13 ' N ' ' A' ' 6' ' ' GLN . 1.4 tp -120.39 150.11 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.2 -0.937 . . . . 0.0 110.303 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.407 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -172.57 91.46 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -0.915 . . . . 0.0 110.264 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.486 ' N ' ' CD1' ' A' ' 7' ' ' ILE . 1.8 mp -89.53 110.29 37.98 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.0 109.52 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.46 157.35 56.6 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.533 1.281 . . . . 0.0 110.819 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -75.23 164.41 32.99 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.733 1.386 . . . . 0.0 110.522 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.06 -23.79 32.46 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.34 -19.74 29.34 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 0.0 110.312 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.3 m -77.04 -45.64 26.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.237 -0.914 . . . . 0.0 110.286 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -55.05 -57.35 12.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.304 -0.872 . . . . 0.0 110.121 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.03 -54.03 41.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 110.238 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.867 . . . . 0.0 110.244 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.26 -40.03 73.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.145 -0.972 . . . . 0.0 109.787 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.55 -53.65 39.91 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.422 ' OH ' ' CB ' ' A' ' 34' ' ' ALA . 1.4 t80 -48.49 -48.72 37.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.426 -1.044 . . . . 0.0 110.209 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 51.8 m -54.5 -32.5 58.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.474 -0.766 . . . . 0.0 110.221 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.19 -24.62 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.229 -0.919 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.48 ' OE2' ' CE1' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -88.65 -58.55 2.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.438 HG21 ' CE2' ' A' ' 33' ' ' PHE . 50.4 t -50.59 -41.12 20.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.735 -0.603 . . . . 0.0 110.364 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.2 -34.76 59.29 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.133 -0.98 . . . . 0.0 110.186 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.34 -49.45 14.93 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 110.324 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.09 -37.06 58.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.211 -0.93 . . . . 0.0 110.351 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.431 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 2.1 mt-30 53.21 53.95 12.18 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.237 -0.914 . . . . 0.0 110.285 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 43.5 Cg_endo -70.2 157.13 60.48 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.672 1.354 . . . . 0.0 110.48 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.0 -32.91 10.44 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.653 1.344 . . . . 0.0 110.411 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -120.14 122.75 41.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.229 -0.919 . . . . 0.0 110.281 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 tp -85.69 -36.83 20.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.21 -0.931 . . . . 0.0 110.114 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.8 t -51.47 -57.78 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.21 -0.931 . . . . 0.0 109.903 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -62.36 -37.38 85.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.643 -0.661 . . . . 0.0 110.087 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.438 ' CE2' HG21 ' A' ' 22' ' ' VAL . 74.7 t80 -65.39 -43.17 91.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.274 -0.891 . . . . 0.0 109.783 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.422 ' CB ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.59 -37.93 74.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.404 -0.81 . . . . 0.0 110.062 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.443 HG23 ' N ' ' B' ' 39' ' ' THR . 89.2 t -69.71 -50.34 50.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 O-C-N 121.21 -0.931 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.76 -26.09 65.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.505 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.48 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 12.4 t80 -75.82 -68.69 0.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.125 -0.984 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -57.81 -47.97 81.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 110.625 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 35' ' ' VAL . 64.6 m -51.27 -45.52 62.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.12 -0.987 . . . . 0.0 110.023 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -74.0 -26.49 60.47 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.299 -0.875 . . . . 0.0 109.628 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -53.31 -36.55 61.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.932 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -42.15 92.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.319 -0.863 . . . . 0.0 110.113 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -85.31 -16.33 40.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.293 -0.879 . . . . 0.0 110.452 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.87 -67.91 0.25 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.08 -1.012 . . . . 0.0 110.091 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.95 -45.71 31.49 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.557 -0.714 . . . . 0.0 110.835 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.379 -179.808 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.294 0.569 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.0 mtm -110.65 105.44 14.34 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 110.119 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.98 100.53 2.3 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -143.89 152.11 40.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -1.184 . . . . 0.0 110.254 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.41 HG13 ' N ' ' B' ' 6' ' ' GLN . 1.4 tp -120.34 150.05 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.295 -0.878 . . . . 0.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . 0.41 ' N ' HG13 ' B' ' 5' ' ' ILE . 0.0 OUTLIER -172.6 91.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.276 -0.89 . . . . 0.0 110.391 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . 0.483 ' N ' ' CD1' ' B' ' 7' ' ' ILE . 1.8 mp -89.35 110.15 36.65 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.277 -0.89 . . . . 0.0 109.57 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.48 157.33 56.56 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.565 1.297 . . . . 0.0 110.782 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -75.18 164.24 33.4 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.8 1.421 . . . . 0.0 110.508 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.2 -23.85 32.12 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.36 -19.62 29.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -1.136 . . . . 0.0 110.308 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 66.5 m -77.14 -45.66 26.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.239 -0.913 . . . . 0.0 110.269 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -54.98 -57.41 11.79 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.147 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.07 -53.98 42.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.333 -0.855 . . . . 0.0 110.245 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.35 -40.67 74.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -39.76 72.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.116 -0.99 . . . . 0.0 109.922 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.91 -53.47 41.91 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 108.807 -1.717 . . . . 0.0 108.807 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.419 ' OH ' ' CB ' ' B' ' 34' ' ' ALA . 1.5 t80 -48.7 -48.46 40.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.429 -1.042 . . . . 0.0 110.263 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.2 m -54.58 -32.43 58.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.469 -0.769 . . . . 0.0 110.185 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 96.2 t -81.25 -24.85 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 110.54 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.471 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.8 OUTLIER -88.44 -58.47 2.54 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.181 -0.949 . . . . 0.0 109.296 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.427 HG21 ' CE2' ' B' ' 33' ' ' PHE . 49.8 t -50.67 -40.96 20.11 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.765 -0.584 . . . . 0.0 110.414 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.3 -34.9 59.05 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.175 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.29 -49.35 15.2 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.141 -0.975 . . . . 0.0 110.339 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -76.23 -36.96 58.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.425 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 2.1 mt-30 53.15 53.97 12.29 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.352 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.7 Cg_endo -70.22 157.04 60.75 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.735 1.387 . . . . 0.0 110.503 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.76 -33.1 10.71 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.729 1.384 . . . . 0.0 110.498 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -120.08 123.03 42.39 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.18 -0.95 . . . . 0.0 110.365 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -85.81 -37.12 19.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.074 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 46.0 t -51.04 -57.93 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.261 -0.9 . . . . 0.0 110.004 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -62.31 -37.43 85.53 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.527 -0.733 . . . . 0.0 110.17 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.427 ' CE2' HG21 ' B' ' 22' ' ' VAL . 74.4 t80 -65.17 -43.45 91.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.854 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.419 ' CB ' ' OH ' ' B' ' 18' ' ' TYR . . . -57.38 -38.15 73.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.306 -0.871 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 99.9 t -69.54 -50.18 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 O-C-N 121.271 -0.893 . . . . 0.0 110.183 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.92 -26.12 65.68 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.298 -0.876 . . . . 0.0 110.512 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.471 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 12.2 t80 -75.91 -68.66 0.55 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.409 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 45.7 m-85 -57.81 -47.71 81.83 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.909 . . . . 0.0 110.534 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.443 ' N ' HG23 ' A' ' 35' ' ' VAL . 68.9 m -51.47 -45.64 62.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.022 -1.049 . . . . 0.0 109.963 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -73.74 -26.78 60.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 109.688 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -53.29 -36.55 61.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 109.91 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.48 93.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 110.036 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -84.89 -16.42 41.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.401 -0.812 . . . . 0.0 110.529 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.88 -67.59 0.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.146 -0.971 . . . . 0.0 110.295 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.95 -45.95 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.532 -0.73 . . . . 0.0 110.695 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 37.3 ttm-85 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.409 -179.874 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.0 m170 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.24 0.543 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 14.9 mmt -116.01 136.93 52.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.34 -0.85 . . . . 0.0 110.164 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -124.49 -170.58 13.23 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -129.73 32.85 4.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.181 -1.188 . . . . 0.0 110.135 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 48.0 mm -106.36 126.91 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.265 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -118.08 108.68 15.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.254 -0.904 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.45 115.06 52.33 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.142 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.21 137.43 28.66 Favored 'Trans proline' 0 C--N 1.313 -1.29 0 O-C-N 123.451 1.237 . . . . 0.0 110.406 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.25 151.11 38.04 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.573 1.302 . . . . 0.0 110.517 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.86 -27.71 8.52 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -26.08 30.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.224 -1.163 . . . . 0.0 110.303 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -53.47 -56.4 17.27 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.219 -0.926 . . . . 0.0 110.323 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.46 -50.14 63.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.401 -0.812 . . . . 0.0 110.408 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mp -52.83 -53.49 47.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.342 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.41 ' N ' HD23 ' A' ' 15' ' ' LEU . 4.6 mm? -65.37 -51.89 57.39 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 110.434 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.5 -33.05 43.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.062 -1.024 . . . . 0.0 109.897 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.23 -55.85 28.48 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 108.913 -1.675 . . . . 0.0 108.913 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.484 ' CE2' HD13 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -48.2 -44.78 33.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.407 -1.055 . . . . 0.0 110.391 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -55.63 -37.32 68.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.416 -0.802 . . . . 0.0 110.204 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.6 t -80.56 -25.64 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.671 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -85.67 -58.48 2.64 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.001 -1.062 . . . . 0.0 109.083 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 38.9 t -52.03 -34.09 17.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.757 -0.589 . . . . 0.0 110.179 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.5 -33.9 54.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.07 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.54 -66.28 0.91 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.263 -0.898 . . . . 0.0 110.12 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.71 -40.89 66.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.068 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.49 56.61 13.75 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.307 -0.871 . . . . 0.0 110.364 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.51 151.32 58.85 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.66 1.347 . . . . 0.0 110.295 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.78 -28.39 20.43 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.701 1.369 . . . . 0.0 110.26 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.65 120.05 30.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.315 -0.866 . . . . 0.0 110.086 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.484 HD13 ' CE2' ' A' ' 18' ' ' TYR . 9.4 tp -82.88 -36.63 25.2 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 110.287 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.8 t -51.02 -63.58 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.186 -0.946 . . . . 0.0 110.112 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.48 -35.76 72.69 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.455 -0.778 . . . . 0.0 110.103 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -66.58 -43.18 85.61 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 109.909 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.77 -35.29 74.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.389 -0.819 . . . . 0.0 110.275 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.4 t -74.24 -45.56 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 121.224 -0.923 . . . . 0.0 110.341 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.47 -20.64 66.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.25 -0.906 . . . . 0.0 110.373 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.51 -71.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.19 -0.944 . . . . 0.0 110.353 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -56.48 -47.21 79.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.203 -0.936 . . . . 0.0 110.447 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.3 m -51.82 -42.85 62.82 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -75.15 -23.45 57.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.194 -0.941 . . . . 0.0 110.03 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -32.73 74.39 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.291 -0.88 . . . . 0.0 110.033 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -29.4 34.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.304 -0.872 . . . . 0.0 110.017 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.4 -23.24 40.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.418 -0.802 . . . . 0.0 110.1 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.28 -75.73 0.14 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.383 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 48.81 -153.65 0.1 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.607 -0.683 . . . . 0.0 110.624 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.237 -179.951 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 38.0 m170 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.16 0.505 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 15.0 mmt -115.98 136.86 52.64 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.0 110.211 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -124.29 -170.49 13.26 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -129.89 32.81 4.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.298 -1.119 . . . . 0.0 110.144 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 47.9 mm -106.41 126.77 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.341 -0.85 . . . . 0.0 110.295 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -117.87 108.84 15.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 110.273 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.57 114.95 52.14 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.073 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.09 137.42 28.94 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 123.436 1.229 . . . . 0.0 110.44 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -75.24 150.99 37.93 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.616 1.324 . . . . 0.0 110.454 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.01 -27.81 8.4 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -26.01 31.06 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.281 -1.129 . . . . 0.0 110.263 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 38.9 m -53.64 -56.25 18.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.278 -0.889 . . . . 0.0 110.309 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.58 -50.19 63.48 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.361 -0.837 . . . . 0.0 110.365 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.75 -53.57 46.14 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.388 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.412 ' N ' HD23 ' B' ' 15' ' ' LEU . 4.6 mm? -65.27 -51.9 57.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.216 -0.928 . . . . 0.0 110.404 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.58 -33.09 44.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.085 -1.01 . . . . 0.0 109.905 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.15 -55.87 28.38 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 108.929 -1.669 . . . . 0.0 108.929 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.483 ' CE2' HD13 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -48.23 -44.57 33.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.37 -1.077 . . . . 0.0 110.416 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.2 m -55.74 -37.41 68.44 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 110.264 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 86.3 t -80.4 -25.8 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.707 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -85.58 -58.34 2.7 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.999 -1.063 . . . . 0.0 109.158 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.25 -33.98 17.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.775 -0.578 . . . . 0.0 110.27 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.61 -33.77 53.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.166 -0.959 . . . . 0.0 109.976 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.59 -66.17 0.92 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -0.886 . . . . 0.0 110.105 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.79 -41.02 66.8 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 109.973 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.61 56.51 13.5 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.432 -0.793 . . . . 0.0 110.317 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.32 151.31 60.0 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.603 1.317 . . . . 0.0 110.307 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.65 -28.49 20.9 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.744 1.392 . . . . 0.0 110.327 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.6 120.3 31.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.369 -0.832 . . . . 0.0 110.052 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.483 HD13 ' CE2' ' B' ' 18' ' ' TYR . 9.1 tp -83.18 -36.36 24.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.247 -0.908 . . . . 0.0 110.216 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -51.17 -63.44 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.246 -0.909 . . . . 0.0 110.052 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.62 -35.76 72.99 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.412 -0.805 . . . . 0.0 110.17 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -66.55 -43.28 85.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.196 -0.94 . . . . 0.0 109.829 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.66 -35.45 74.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 110.258 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 91.0 t -74.24 -45.37 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.184 -0.948 . . . . 0.0 110.359 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.6 -20.56 66.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.57 -71.4 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.147 -0.971 . . . . 0.0 110.36 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -56.32 -47.2 79.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.928 . . . . 0.0 110.435 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 86.8 m -51.78 -42.88 62.75 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.173 -0.954 . . . . 0.0 110.307 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -75.06 -23.64 58.09 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.266 -0.896 . . . . 0.0 110.064 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -32.88 74.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.225 -0.922 . . . . 0.0 110.069 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -29.44 32.91 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.205 -0.934 . . . . 0.0 109.996 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.4 -23.3 40.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.23 -75.8 0.14 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.849 . . . . 0.0 110.393 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 48.89 -153.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.619 -0.675 . . . . 0.0 110.615 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.208 179.999 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.242 0.544 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 ttp -140.94 26.73 2.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.2 -0.938 . . . . 0.0 110.132 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 98.01 94.77 1.96 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -163.41 130.7 3.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.257 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -111.01 64.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.258 -0.901 . . . . 0.0 110.177 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -104.99 175.4 5.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.6 mm -99.79 104.84 30.8 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.27 147.21 59.12 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.608 1.32 . . . . 0.0 110.591 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.22 171.08 16.72 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.717 1.377 . . . . 0.0 110.493 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.22 -32.54 6.81 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 tp -87.82 -41.01 13.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.263 -1.14 . . . . 0.0 110.116 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.2 m -57.86 -57.61 12.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.976 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.08 21.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.404 -0.81 . . . . 0.0 109.984 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -49.58 14.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 109.997 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.39 -53.1 32.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.268 -0.895 . . . . 0.0 109.991 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.15 -43.16 63.92 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.818 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.15 -52.11 49.37 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.441 ' OH ' ' CA ' ' A' ' 34' ' ' ALA . 1.7 t80 -49.14 -49.34 42.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.405 -1.056 . . . . 0.0 110.17 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.0 m -55.7 -36.62 67.38 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.422 -0.799 . . . . 0.0 110.012 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.04 -25.1 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.249 -0.907 . . . . 0.0 110.601 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.468 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -86.87 -57.99 2.77 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.178 -0.951 . . . . 0.0 109.254 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.2 t -48.17 -30.99 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.753 -0.592 . . . . 0.0 110.484 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.8 tp -81.89 -37.71 26.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.189 -0.944 . . . . 0.0 110.128 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -27.73 51.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.481 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.421 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 3.5 pm0 -135.48 51.26 2.08 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.11 -0.994 . . . . 0.0 110.615 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -37.75 97.98 0.15 Allowed Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.964 -0.46 . . . . 0.0 111.458 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.421 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.6 Cg_endo -74.11 166.31 29.88 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.984 1.518 . . . . 0.0 110.552 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.59 -41.7 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.704 1.371 . . . . 0.0 110.273 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -122.04 116.38 24.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.896 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.83 -45.1 68.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.225 -0.922 . . . . 0.0 109.686 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -51.79 -59.88 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.902 . . . . 0.0 109.881 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.46 -38.74 78.16 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.582 -0.699 . . . . 0.0 109.994 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -60.31 -46.97 88.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.933 . . . . 0.0 109.685 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HB2' ' CD2' ' B' ' 38' ' ' PHE . . . -50.96 -38.44 50.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.425 -0.797 . . . . 0.0 110.389 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.422 ' O ' ' CB ' ' A' ' 39' ' ' THR . 46.4 t -71.48 -55.28 14.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.214 -0.929 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.37 -38.34 68.72 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.262 -0.899 . . . . 0.0 110.589 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.468 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 14.6 t80 -68.07 -64.87 0.78 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.55 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.475 ' CD2' ' HB2' ' B' ' 34' ' ' ALA . 23.1 m-85 -60.23 -45.58 92.74 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.256 -0.902 . . . . 0.0 110.665 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.422 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 96.6 m -56.44 -42.45 78.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.0 110.399 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -73.9 -27.11 60.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.12 -0.987 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.19 -36.71 78.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.254 -0.903 . . . . 0.0 110.269 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.58 -40.28 74.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 110.313 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -80.54 -30.93 37.12 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.175 -0.953 . . . . 0.0 110.221 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.34 -71.41 0.07 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.257 -0.902 . . . . 0.0 110.358 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -50.33 -40.89 50.32 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.439 -0.788 . . . . 0.0 110.461 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.4 ttt180 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.287 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.289 0.566 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttp -141.05 26.9 2.0 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.249 -0.907 . . . . 0.0 110.178 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 97.84 94.7 1.95 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -163.3 130.71 3.52 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.287 -1.125 . . . . 0.0 110.255 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.87 64.71 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.172 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -105.14 175.26 5.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 46.7 mm -99.69 104.95 31.12 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 109.976 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.33 147.29 58.89 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 123.556 1.293 . . . . 0.0 110.51 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.25 171.04 16.83 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.72 1.379 . . . . 0.0 110.539 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.23 -32.52 6.83 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.265 -1.534 . . . . 0.0 109.265 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 tp -87.84 -40.95 13.58 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.329 -1.101 . . . . 0.0 110.083 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 97.3 m -57.95 -57.54 12.34 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.168 -0.957 . . . . 0.0 109.941 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.15 21.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.365 -0.835 . . . . 0.0 109.911 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.34 -49.86 14.05 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.338 -0.851 . . . . 0.0 109.951 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.31 -52.96 34.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -43.06 64.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.113 -0.992 . . . . 0.0 109.766 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.33 -51.84 51.64 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 108.826 -1.71 . . . . 0.0 108.826 179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.436 ' OH ' ' CA ' ' B' ' 34' ' ' ALA . 1.7 t80 -49.33 -49.28 44.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.41 -1.053 . . . . 0.0 110.119 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 45.3 m -55.69 -36.71 67.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.452 -0.78 . . . . 0.0 110.049 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 47.6 t -75.04 -25.04 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 110.518 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.46 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 1.0 OUTLIER -86.78 -58.2 2.69 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.039 -1.038 . . . . 0.0 109.338 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 41.1 t -48.04 -30.89 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.77 -0.582 . . . . 0.0 110.559 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 tp -82.06 -37.6 26.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.97 . . . . 0.0 110.099 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -27.84 50.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.258 -0.901 . . . . 0.0 110.415 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.423 ' O ' ' HD3' ' B' ' 27' ' ' PRO . 3.4 pm0 -135.44 51.45 2.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.135 -0.978 . . . . 0.0 110.52 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -37.94 98.05 0.15 Allowed Pre-proline 0 N--CA 1.5 2.035 0 O-C-N 122.009 -0.432 . . . . 0.0 111.464 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 47.8 Cg_endo -74.13 166.25 30.02 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.939 1.494 . . . . 0.0 110.58 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.48 -41.84 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.663 1.349 . . . . 0.0 110.263 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -121.93 116.49 24.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 110.268 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.99 -45.06 68.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 109.655 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.0 t -51.72 -59.95 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 109.776 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.41 -38.95 78.43 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.668 -0.645 . . . . 0.0 109.914 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -60.21 -46.86 88.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.927 . . . . 0.0 109.699 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.475 ' HB2' ' CD2' ' A' ' 38' ' ' PHE . . . -50.95 -38.55 51.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.369 -0.832 . . . . 0.0 110.333 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.428 ' O ' ' CB ' ' B' ' 39' ' ' THR . 46.4 t -71.39 -55.41 13.89 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.193 -0.942 . . . . 0.0 110.299 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -55.2 -38.4 68.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.46 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 14.6 t80 -68.14 -64.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.888 . . . . 0.0 110.501 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.495 ' CD2' ' HB2' ' A' ' 34' ' ' ALA . 23.4 m-85 -60.31 -45.38 93.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.733 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.428 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 96.9 m -56.66 -42.23 78.6 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.992 -1.068 . . . . 0.0 110.348 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -74.22 -26.88 60.51 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.29 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.26 -36.58 78.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.0 110.303 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.68 -40.28 75.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.236 -0.915 . . . . 0.0 110.409 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -80.51 -30.97 37.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.163 -0.961 . . . . 0.0 110.232 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.26 -71.42 0.07 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.334 -0.854 . . . . 0.0 110.347 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -50.19 -41.06 48.87 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.504 -0.748 . . . . 0.0 110.475 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 11.4 ttt180 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.214 -179.968 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.226 0.536 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.95 64.36 1.54 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.3 -0.875 . . . . 0.0 110.16 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.69 67.09 0.01 OUTLIER Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 10.2 m80 -143.75 -68.24 0.33 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.167 -1.196 . . . . 0.0 110.273 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.423 HG13 ' N ' ' A' ' 6' ' ' GLN . 5.6 tp -113.42 154.55 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.846 . . . . 0.0 110.201 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.423 ' N ' HG13 ' A' ' 5' ' ' ILE . 10.3 mm100 -112.36 135.14 53.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.283 -0.886 . . . . 0.0 110.175 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.466 ' N ' ' CD1' ' A' ' 7' ' ' ILE . 4.5 mp -129.45 57.32 29.63 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.198 -0.939 . . . . 0.0 109.95 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.77 151.04 57.07 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.766 1.403 . . . . 0.0 110.607 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.99 178.27 6.7 Favored 'Trans proline' 0 C--N 1.311 -1.395 0 O-C-N 123.749 1.394 . . . . 0.0 110.364 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.35 -25.96 12.88 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -51.16 5.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.174 -1.192 . . . . 0.0 110.27 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 m -52.79 -25.57 11.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.239 -0.913 . . . . 0.0 110.157 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.44 -58.96 3.32 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.165 -0.96 . . . . 0.0 110.239 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.68 -41.47 73.76 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.098 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.29 -44.81 95.05 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.328 -0.857 . . . . 0.0 110.087 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.05 -38.56 65.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.956 . . . . 0.0 109.698 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.53 -58.39 14.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.426 ' OH ' ' CB ' ' A' ' 34' ' ' ALA . 1.7 t80 -46.0 -40.24 10.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.511 -0.993 . . . . 0.0 110.685 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.2 m -62.7 -36.01 81.57 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.388 -0.82 . . . . 0.0 110.01 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 96.8 t -82.18 -21.84 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.26 -0.9 . . . . 0.0 110.745 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.454 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.24 8.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.028 -1.045 . . . . 0.0 109.332 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.438 HG12 ' CD1' ' A' ' 30' ' ' LEU . 76.9 t -60.71 -34.5 59.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 121.7 -0.625 . . . . 0.0 110.408 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.36 -41.32 22.18 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.124 -0.985 . . . . 0.0 110.277 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -69.57 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.38 -36.87 64.35 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.253 -0.904 . . . . 0.0 110.173 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.11 59.6 14.47 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.23 -0.919 . . . . 0.0 110.157 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.98 149.8 59.73 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.715 1.376 . . . . 0.0 110.508 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.99 -29.98 17.25 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.723 1.38 . . . . 0.0 110.294 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -125.06 119.64 29.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.438 ' CD1' HG12 ' A' ' 22' ' ' VAL . 5.3 tp -78.6 -35.68 45.39 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.246 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -51.05 -68.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.228 -0.92 . . . . 0.0 110.108 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.99 -41.54 71.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.469 -0.77 . . . . 0.0 109.785 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -58.58 -51.81 68.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.534 179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.426 ' CB ' ' OH ' ' A' ' 18' ' ' TYR . . . -53.66 -44.62 69.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.439 -0.788 . . . . 0.0 110.022 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.437 HG23 ' N ' ' B' ' 39' ' ' THR . 92.9 t -71.04 -29.74 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 O-C-N 121.315 -0.866 . . . . 0.0 110.07 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.23 -26.6 39.02 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.259 -0.901 . . . . 0.0 109.586 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.454 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 27.8 t80 -76.57 -68.12 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.206 -0.933 . . . . 0.0 110.427 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -52.94 -45.81 67.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.304 -0.872 . . . . 0.0 110.65 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.407 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 24.0 m -54.51 -40.89 69.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.983 -1.073 . . . . 0.0 109.889 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -28.75 68.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 mt -75.57 -24.65 56.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 110.337 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -47.91 50.11 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.225 -0.922 . . . . 0.0 109.695 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.41 -26.91 68.74 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.356 -0.84 . . . . 0.0 110.047 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.96 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.335 -0.853 . . . . 0.0 110.202 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.06 -64.08 0.89 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.538 -0.726 . . . . 0.0 110.696 -179.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.243 0.544 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.04 64.31 1.54 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.274 -0.891 . . . . 0.0 110.227 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.79 66.93 0.01 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -143.66 -68.17 0.34 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -1.171 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.413 HG13 ' N ' ' B' ' 6' ' ' GLN . 5.5 tp -113.51 154.53 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.296 -0.878 . . . . 0.0 110.157 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . 0.413 ' N ' HG13 ' B' ' 5' ' ' ILE . 10.3 mm100 -112.22 134.96 53.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.217 -0.927 . . . . 0.0 110.258 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' B' ' 7' ' ' ILE . 4.5 mp -129.27 57.39 29.92 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.331 -0.855 . . . . 0.0 110.086 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.83 151.04 56.67 Favored 'Trans proline' 0 C--N 1.31 -1.489 0 O-C-N 123.682 1.359 . . . . 0.0 110.683 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.96 178.25 6.7 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.706 1.372 . . . . 0.0 110.415 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.27 -25.85 13.16 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.58 -51.06 5.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.134 -1.215 . . . . 0.0 110.293 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 69.3 m -52.98 -25.57 12.48 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.224 -0.922 . . . . 0.0 110.205 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -69.33 -59.09 3.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 110.16 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.51 -41.56 73.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.14 -44.91 94.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.191 -0.943 . . . . 0.0 110.128 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -38.58 65.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.74 -58.23 15.66 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.93 -1.668 . . . . 0.0 108.93 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.423 ' OH ' ' CB ' ' B' ' 34' ' ' ALA . 1.7 t80 -45.92 -40.33 10.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.534 -0.98 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 80.1 m -62.72 -35.97 81.47 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.104 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 98.8 t -82.27 -21.72 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.749 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.464 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.39 8.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.082 -1.011 . . . . 0.0 109.213 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.437 HG12 ' CD1' ' B' ' 30' ' ' LEU . 73.6 t -60.6 -34.55 58.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.762 -0.586 . . . . 0.0 110.452 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.26 -41.34 22.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.122 -0.986 . . . . 0.0 110.251 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -69.62 0.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.302 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.24 -36.75 63.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.304 -0.873 . . . . 0.0 110.269 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 51.94 59.77 14.47 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.267 -0.896 . . . . 0.0 110.174 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.02 149.76 59.43 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.682 1.359 . . . . 0.0 110.529 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -71.04 -29.98 17.06 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.655 1.345 . . . . 0.0 110.327 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -125.03 119.6 29.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.134 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.437 ' CD1' HG12 ' B' ' 22' ' ' VAL . 5.3 tp -78.43 -35.9 46.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.191 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.5 t -50.88 -68.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.277 -0.89 . . . . 0.0 110.203 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.94 -41.61 71.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.394 -0.816 . . . . 0.0 109.711 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -58.54 -51.99 67.56 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.294 -0.879 . . . . 0.0 109.511 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.423 ' CB ' ' OH ' ' B' ' 18' ' ' TYR . . . -53.66 -44.5 69.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.363 -0.836 . . . . 0.0 110.027 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.407 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 90.9 t -71.13 -29.73 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.269 -0.895 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.06 -26.6 39.59 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.241 -0.912 . . . . 0.0 109.546 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.464 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 27.8 t80 -76.67 -68.03 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.17 -0.956 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -53.03 -45.7 68.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.592 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.437 ' N ' HG23 ' A' ' 35' ' ' VAL . 23.8 m -54.55 -41.11 69.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.022 -1.049 . . . . 0.0 109.753 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -28.83 68.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.188 -0.945 . . . . 0.0 109.974 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.1 mt -75.64 -24.65 56.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 110.341 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -47.78 51.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.169 -0.957 . . . . 0.0 109.684 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.52 -26.88 68.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.972 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.78 -63.21 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.317 -0.865 . . . . 0.0 110.138 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.12 -64.08 0.89 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.559 -0.713 . . . . 0.0 110.731 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.18 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.263 0.554 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -111.66 -47.81 3.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.122 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.11 117.03 0.31 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.6 t60 -151.45 90.79 1.6 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -1.151 . . . . 0.0 110.184 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.5 tp -118.04 141.31 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.218 -0.926 . . . . 0.0 110.244 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -127.09 64.47 1.31 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.256 -0.902 . . . . 0.0 110.072 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -133.93 151.69 77.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.28 -0.888 . . . . 0.0 110.242 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.54 125.5 10.69 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.685 1.361 . . . . 0.0 110.131 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -73.2 159.26 47.62 Favored 'Trans proline' 0 C--N 1.313 -1.335 0 O-C-N 123.468 1.246 . . . . 0.0 110.424 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.08 -32.91 5.96 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -38.49 91.02 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -1.158 . . . . 0.0 110.204 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -53.79 -43.18 69.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.347 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.86 -25.34 66.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.924 . . . . 0.0 110.367 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tp -71.68 -53.07 14.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.4 mt -60.2 -44.49 95.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.08 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -38.21 63.42 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.173 -0.955 . . . . 0.0 109.878 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.29 -57.05 21.16 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.427 ' OH ' ' CB ' ' A' ' 34' ' ' ALA . 1.8 t80 -46.65 -40.57 13.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.524 -0.986 . . . . 0.0 110.575 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.7 m -62.3 -36.57 82.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.394 -0.816 . . . . 0.0 110.267 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.82 -23.37 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.338 -0.851 . . . . 0.0 110.713 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -87.43 -54.36 4.33 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.01 -1.056 . . . . 0.0 109.246 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.15 -33.79 25.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.281 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 mt -78.35 -36.36 46.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.133 -0.98 . . . . 0.0 110.158 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -55.85 4.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.219 -0.926 . . . . 0.0 110.193 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.18 -44.13 97.79 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.294 -0.879 . . . . 0.0 110.203 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.63 58.13 14.83 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.296 -0.877 . . . . 0.0 110.312 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -72.35 156.69 54.48 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.589 1.31 . . . . 0.0 110.364 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.45 -19.05 33.33 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.743 1.391 . . . . 0.0 110.509 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.13 119.36 15.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.256 -0.902 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -81.16 -36.25 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.136 -0.977 . . . . 0.0 110.017 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.68 -65.5 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -0.909 . . . . 0.0 109.765 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.24 -41.73 76.19 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.427 -0.795 . . . . 0.0 109.732 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -57.65 -49.23 77.17 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.344 -0.847 . . . . 0.0 109.657 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.427 ' CB ' ' OH ' ' A' ' 18' ' ' TYR . . . -51.93 -34.97 44.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.357 -0.839 . . . . 0.0 110.226 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.29 -53.42 17.23 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.347 -0.846 . . . . 0.0 110.427 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.23 -23.15 46.12 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.0 110.319 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -79.1 -68.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.266 -0.896 . . . . 0.0 110.377 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.429 ' CG ' ' HB2' ' B' ' 34' ' ' ALA . 13.1 m-85 -57.08 -45.72 83.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.237 -0.914 . . . . 0.0 110.39 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 83.5 m -53.57 -48.88 68.76 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.937 . . . . 0.0 110.442 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -35.56 80.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.148 -0.97 . . . . 0.0 110.257 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.3 -43.39 67.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.0 110.27 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 -44.44 62.66 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.182 -0.949 . . . . 0.0 110.452 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.52 -31.18 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.99 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -91.9 -70.02 0.71 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.296 -0.877 . . . . 0.0 110.161 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -52.14 135.6 31.4 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.567 -0.708 . . . . 0.0 110.455 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.141 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.207 0.527 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -111.78 -47.82 3.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.277 -0.889 . . . . 0.0 110.134 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.15 117.14 0.32 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -151.67 90.5 1.56 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -1.166 . . . . 0.0 110.199 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tp -117.74 141.43 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.249 -0.907 . . . . 0.0 110.221 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -127.24 64.5 1.32 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.897 . . . . 0.0 110.079 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 2.4 pp -133.98 151.56 76.94 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.319 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.53 125.45 10.66 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.762 1.401 . . . . 0.0 110.128 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.03 159.32 48.08 Favored 'Trans proline' 0 C--N 1.312 -1.354 0 O-C-N 123.439 1.231 . . . . 0.0 110.419 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.93 -32.99 5.85 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.35 90.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.284 -1.127 . . . . 0.0 110.171 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.0 m -54.03 -43.04 69.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.396 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.82 -25.4 66.42 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.277 -0.889 . . . . 0.0 110.317 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tp -71.72 -52.85 15.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.242 -0.911 . . . . 0.0 110.256 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.36 -44.27 95.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.905 . . . . 0.0 110.067 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -38.3 64.26 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.141 -0.974 . . . . 0.0 109.774 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.13 -57.18 20.4 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.42 ' OH ' ' CB ' ' B' ' 34' ' ' ALA . 1.8 t80 -46.6 -40.39 12.82 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.53 -0.982 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -62.6 -36.29 82.26 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.437 -0.789 . . . . 0.0 110.296 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.96 -23.39 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.759 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -87.58 -54.18 4.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.056 -1.028 . . . . 0.0 109.289 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.18 -33.49 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 O-C-N 121.786 -0.571 . . . . 0.0 110.294 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 mt -78.6 -36.46 44.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.135 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.11 -55.83 4.31 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.26 -44.01 97.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.6 58.1 14.88 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.319 -0.863 . . . . 0.0 110.383 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.42 156.62 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.586 1.309 . . . . 0.0 110.498 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.27 -19.15 34.03 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.709 1.373 . . . . 0.0 110.47 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.16 119.19 15.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.236 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.98 -36.23 31.03 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.022 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.62 -65.67 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.289 -0.882 . . . . 0.0 109.789 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.06 -41.71 75.48 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.52 -0.737 . . . . 0.0 109.744 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.327 -0.858 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.429 ' HB2' ' CG ' ' A' ' 38' ' ' PHE . . . -52.18 -34.89 47.14 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.348 -0.845 . . . . 0.0 110.194 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 61.5 t -74.29 -53.51 16.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.349 -0.844 . . . . 0.0 110.452 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -57.14 -23.24 45.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.428 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -79.06 -68.18 0.68 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.275 -0.891 . . . . 0.0 110.438 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.42 ' CG ' ' HB2' ' A' ' 34' ' ' ALA . 13.2 m-85 -57.2 -45.75 83.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.154 -0.966 . . . . 0.0 110.414 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -53.42 -49.22 67.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.255 -0.903 . . . . 0.0 110.436 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.05 -35.78 81.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.155 -0.965 . . . . 0.0 110.298 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.13 -43.42 66.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.5 -44.55 62.56 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.293 -0.879 . . . . 0.0 110.47 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.42 -31.37 65.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.29 -0.881 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -91.7 -69.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.357 -0.84 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -52.12 135.55 31.35 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.484 -0.76 . . . . 0.0 110.375 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.248 179.923 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.765 HD21 HG11 ' B' ' 22' ' ' VAL . 0.1 OUTLIER -68.67 -57.33 5.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.208 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.6 m -52.4 -28.58 20.36 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.242 -0.911 . . . . 0.0 110.262 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -72.04 -59.19 2.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.625 HD23 ' HE1' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -55.18 -39.44 69.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.923 . . . . 0.0 110.199 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.0 mt -62.91 -43.99 97.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.95 . . . . 0.0 109.957 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.36 -37.95 65.53 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.16 -0.963 . . . . 0.0 109.653 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.44 -55.24 30.69 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.58 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.6 t80 -48.14 -38.83 18.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.404 -1.057 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.85 -36.52 83.53 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.472 -0.768 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.9 -25.07 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.773 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.6 mt-10 -82.69 -57.15 3.45 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.7 HG11 HD21 ' B' ' 11' ' ' LEU . 22.6 t -55.53 -32.91 31.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.126 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.1 -34.53 63.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.261 -0.9 . . . . 0.0 110.233 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.49 -62.59 1.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.204 -0.935 . . . . 0.0 110.362 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.16 -43.12 63.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.216 -0.927 . . . . 0.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.42 62.41 11.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.287 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.23 161.62 45.2 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 O-C-N 123.734 1.386 . . . . 0.0 110.527 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.19 -34.12 10.52 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.638 1.336 . . . . 0.0 110.423 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -129.05 123.85 33.38 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.289 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 tp -77.7 -40.9 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 0.0 110.176 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.427 ' H ' HG23 ' A' ' 31' ' ' VAL . 47.1 t -50.74 -65.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.907 . . . . 0.0 110.019 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.21 -38.95 71.72 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.5 -0.75 . . . . 0.0 110.07 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -62.17 -46.44 88.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.209 -0.932 . . . . 0.0 109.878 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.626 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.33 -33.28 58.58 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 0.0 110.197 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.417 HG13 ' OG1' ' B' ' 39' ' ' THR . 85.7 t -74.96 -49.97 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.333 -0.855 . . . . 0.0 110.248 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.32 -41.03 96.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.236 -0.915 . . . . 0.0 110.332 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.467 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.2 t80 -61.5 -60.12 4.19 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.918 . . . . 0.0 110.3 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.64 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 12.5 m-85 -63.62 -47.78 79.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.431 ' OG1' HG13 ' B' ' 35' ' ' VAL . 54.6 m -52.98 -29.88 31.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.948 . . . . 0.0 109.939 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.13 -34.5 37.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.336 -0.852 . . . . 0.0 109.827 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -23.08 63.76 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.322 -0.861 . . . . 0.0 110.068 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -75.36 -26.4 58.5 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.221 -0.924 . . . . 0.0 109.732 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.31 -0.869 . . . . 0.0 110.484 179.79 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.7 HD21 HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -68.44 -57.45 5.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -1.167 . . . . 0.0 110.235 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.6 m -52.27 -28.6 19.47 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.206 -0.934 . . . . 0.0 110.315 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -71.94 -59.2 2.86 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.184 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.614 HD23 ' HE1' ' B' ' 38' ' ' PHE . 0.2 OUTLIER -55.27 -39.16 69.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.261 -0.9 . . . . 0.0 110.289 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.18 -43.96 96.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.239 -0.913 . . . . 0.0 109.997 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -37.88 65.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.216 -0.928 . . . . 0.0 109.65 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.408 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.31 -55.35 29.96 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.583 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.6 t80 -48.14 -38.82 18.85 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -1.048 . . . . 0.0 110.363 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -36.32 82.93 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.465 -0.772 . . . . 0.0 110.211 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 90.4 t -80.98 -25.24 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.789 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.7 mt-10 -82.53 -57.14 3.47 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.1 -1.0 . . . . 0.0 109.284 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.765 HG11 HD21 ' A' ' 11' ' ' LEU . 22.4 t -55.63 -32.75 31.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 O-C-N 121.708 -0.62 . . . . 0.0 110.101 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.3 -34.38 63.49 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.65 -62.41 1.4 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.25 -0.906 . . . . 0.0 110.346 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.27 -43.22 64.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.311 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.51 62.41 11.12 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.281 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.22 161.51 45.58 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.692 1.364 . . . . 0.0 110.538 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.0 -34.33 10.61 Favored 'Trans proline' 0 C--N 1.31 -1.471 0 O-C-N 123.723 1.38 . . . . 0.0 110.456 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -128.89 124.09 34.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.287 -0.883 . . . . 0.0 110.226 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 tp -77.8 -41.05 38.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 110.082 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.417 HG23 ' H ' ' B' ' 31' ' ' VAL . 46.6 t -50.52 -65.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.245 -0.909 . . . . 0.0 110.046 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.17 -38.99 71.67 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.487 -0.758 . . . . 0.0 110.041 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -62.07 -46.5 88.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.898 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.64 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -54.3 -33.44 58.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.437 -0.79 . . . . 0.0 110.217 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.431 HG13 ' OG1' ' A' ' 39' ' ' THR . 86.7 t -74.87 -49.84 27.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.55 -40.76 95.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.353 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 33.0 t80 -61.65 -60.22 4.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.198 -0.939 . . . . 0.0 110.282 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.626 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 12.5 m-85 -63.48 -47.61 81.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.343 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.417 ' OG1' HG13 ' A' ' 35' ' ' VAL . 52.9 m -53.13 -29.94 34.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.123 -0.986 . . . . 0.0 109.972 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.1 -34.49 37.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 109.87 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.11 -23.09 63.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.337 -0.852 . . . . 0.0 110.084 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -75.43 -26.47 58.37 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.281 -0.887 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.893 . . . . 0.0 110.499 179.754 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.94 -32.38 72.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -1.172 . . . . 0.0 110.188 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.8 m -69.72 -30.88 68.61 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.158 -0.964 . . . . 0.0 110.228 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -71.48 -54.54 10.26 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.269 -0.894 . . . . 0.0 110.208 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.855 HD21 ' CE1' ' A' ' 38' ' ' PHE . 1.0 OUTLIER -55.59 -53.56 54.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.261 -0.899 . . . . 0.0 110.241 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.852 HD11 HD11 ' B' ' 15' ' ' LEU . 1.2 mm? -53.55 -38.86 64.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.227 -0.921 . . . . 0.0 110.193 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -43.93 70.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.14 -0.975 . . . . 0.0 109.956 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -55.67 -55.69 27.5 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.474 ' CD2' HG21 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -49.24 -47.48 46.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.42 -1.047 . . . . 0.0 110.31 179.552 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 77.7 m -53.15 -36.18 60.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.393 -0.817 . . . . 0.0 110.316 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.26 -25.0 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.174 -0.954 . . . . 0.0 110.417 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.4 mt-10 -89.13 -60.15 2.03 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.21 -0.931 . . . . 0.0 109.2 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.474 HG21 ' CD2' ' A' ' 18' ' ' TYR . 25.4 t -53.59 -26.71 13.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.75 -0.594 . . . . 0.0 110.116 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.409 ' CB ' ' O ' ' A' ' 19' ' ' THR . 2.7 tp -85.08 -35.69 21.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.295 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.27 -56.25 3.34 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.362 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.39 -41.94 81.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.158 -0.964 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 52.04 59.07 15.19 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.245 -0.909 . . . . 0.0 110.161 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.26 156.77 58.53 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.675 1.355 . . . . 0.0 110.573 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.45 -27.48 19.05 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.764 1.402 . . . . 0.0 110.453 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.19 119.93 21.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.41 -32.63 28.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.142 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.504 HG12 ' HD3' ' B' ' 42' ' ' ARG . 39.8 t -53.14 -64.67 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.251 -0.905 . . . . 0.0 109.829 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.91 77.81 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.527 -0.733 . . . . 0.0 109.958 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.55 -48.38 81.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.931 . . . . 0.0 109.521 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.518 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -55.4 -35.06 64.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.873 . . . . 0.0 109.585 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.432 ' CG1' ' OG1' ' B' ' 39' ' ' THR . 55.3 t -81.85 -44.37 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.424 -0.797 . . . . 0.0 109.723 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -26.76 66.96 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.222 -0.924 . . . . 0.0 109.855 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.442 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 38.3 t80 -78.88 -68.02 0.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 110.296 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.855 ' CE1' HD21 ' A' ' 14' ' ' LEU . 17.0 m-85 -52.21 -50.97 60.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.206 -0.934 . . . . 0.0 110.49 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.423 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 90.4 m -50.68 -52.92 35.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.36 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -63.43 -24.07 67.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.45 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.1 tt -65.05 -29.35 70.23 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 109.997 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.44 ' HD3' HG12 ' B' ' 31' ' ' VAL . 0.1 OUTLIER -60.22 -58.14 9.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.332 -0.855 . . . . 0.0 110.174 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.324 -0.86 . . . . 0.0 110.35 -179.915 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.5 tp -67.94 -32.46 72.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -1.149 . . . . 0.0 110.144 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 86.0 m -69.8 -30.68 68.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.304 -0.872 . . . . 0.0 110.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -71.61 -54.4 10.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.848 HD21 ' CE1' ' B' ' 38' ' ' PHE . 1.0 OUTLIER -55.77 -53.51 55.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.852 HD11 HD11 ' A' ' 15' ' ' LEU . 1.2 mm? -53.5 -38.96 64.2 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.32 -0.863 . . . . 0.0 110.208 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -44.17 70.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.283 -0.886 . . . . 0.0 109.946 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.41 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -55.37 -55.96 25.83 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.488 ' CD2' HG21 ' B' ' 22' ' ' VAL . 0.9 OUTLIER -49.0 -47.49 44.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.373 -1.075 . . . . 0.0 110.401 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.412 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 76.1 m -53.22 -36.14 60.7 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.423 -0.798 . . . . 0.0 110.323 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -78.19 -25.2 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.246 -0.909 . . . . 0.0 110.4 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.455 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.4 mt-10 -88.91 -60.14 2.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.236 -0.915 . . . . 0.0 109.257 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.488 HG21 ' CD2' ' B' ' 18' ' ' TYR . 25.0 t -53.51 -26.78 13.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.676 -0.64 . . . . 0.0 110.149 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.412 ' CB ' ' O ' ' B' ' 19' ' ' THR . 2.7 tp -85.05 -35.73 21.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 -56.32 3.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.893 . . . . 0.0 110.335 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.26 -41.88 80.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.135 -0.978 . . . . 0.0 110.49 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 51.92 59.17 15.22 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.192 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 156.89 57.87 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 O-C-N 123.755 1.397 . . . . 0.0 110.535 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.54 -27.48 18.75 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.676 1.356 . . . . 0.0 110.411 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.2 119.9 21.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.37 -32.84 29.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.886 . . . . 0.0 110.16 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.44 HG12 ' HD3' ' A' ' 42' ' ' ARG . 39.8 t -52.9 -64.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.264 -0.897 . . . . 0.0 109.865 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.94 77.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.558 -0.714 . . . . 0.0 109.976 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -61.44 -48.52 80.8 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.19 -0.944 . . . . 0.0 109.54 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.508 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -55.32 -35.28 64.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.375 -0.828 . . . . 0.0 109.573 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.423 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 57.1 t -81.66 -44.17 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 O-C-N 121.477 -0.764 . . . . 0.0 109.783 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.27 -26.65 66.67 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.455 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 38.4 t80 -78.98 -67.9 0.71 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.146 -0.971 . . . . 0.0 110.283 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.848 ' CE1' HD21 ' B' ' 14' ' ' LEU . 16.9 m-85 -52.22 -51.01 60.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.239 -0.913 . . . . 0.0 110.426 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.432 ' OG1' ' CG1' ' A' ' 35' ' ' VAL . 84.8 m -50.69 -52.94 35.31 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.38 -24.2 67.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.342 -0.849 . . . . 0.0 109.955 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.435 ' O ' HD23 ' B' ' 41' ' ' LEU . 1.1 tt -64.91 -29.33 70.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.504 ' HD3' HG12 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -60.22 -58.25 9.3 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.328 -0.857 . . . . 0.0 110.127 179.874 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.912 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.342 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.3 tp -77.5 -38.57 48.67 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -1.152 . . . . 0.0 110.37 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.7 m -63.46 -37.93 89.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.205 -0.935 . . . . 0.0 110.383 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.04 -41.76 68.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 110.282 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.56 -44.13 71.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.225 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.687 HD21 ' HD2' ' B' ' 18' ' ' TYR . 91.8 mt -67.83 -51.58 46.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 0.0 110.173 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.42 -34.61 25.11 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.068 -1.02 . . . . 0.0 109.932 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.44 -58.74 12.81 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.673 ' HD2' HD21 ' B' ' 15' ' ' LEU . 1.3 t80 -47.54 -44.56 26.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.447 -1.031 . . . . 0.0 110.663 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 m -50.74 -55.72 15.36 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.048 -1.033 . . . . 0.0 108.906 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.79 -44.27 98.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -52.55 -69.05 0.12 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.426 0.632 . . . . 0.0 110.768 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -52.44 -22.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.389 -0.819 . . . . 0.0 110.519 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.88 -20.99 34.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 110.195 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.77 -56.53 2.26 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.215 -0.928 . . . . 0.0 110.163 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -57.09 -43.58 82.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.26 -0.9 . . . . 0.0 110.148 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.454 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 0.0 OUTLIER 52.57 52.79 11.43 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.372 -0.83 . . . . 0.0 110.162 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 45.1 Cg_endo -71.28 156.18 59.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.633 1.333 . . . . 0.0 110.395 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.33 -29.84 16.4 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.658 1.346 . . . . 0.0 110.167 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.64 119.59 29.45 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.46 -41.93 23.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 0.0 110.346 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.558 HG12 ' HG2' ' B' ' 42' ' ' ARG . 41.2 t -50.7 -59.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.234 -0.916 . . . . 0.0 110.047 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -62.01 -36.02 80.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.508 -0.745 . . . . 0.0 110.024 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.419 ' HD2' ' HH ' ' A' ' 18' ' ' TYR . 53.3 t80 -65.49 -44.11 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.287 -0.883 . . . . 0.0 109.706 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.425 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.12 -36.07 70.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.443 -0.786 . . . . 0.0 110.124 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.541 HG13 ' OG1' ' B' ' 39' ' ' THR . 98.1 t -78.06 -44.91 27.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.56 -30.29 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.386 -0.821 . . . . 0.0 110.55 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -76.71 -58.26 3.38 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.157 -0.964 . . . . 0.0 110.376 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.404 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 12.6 m-85 -65.57 -43.17 90.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.546 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.488 ' OG1' HG13 ' B' ' 35' ' ' VAL . 53.7 m -54.68 -44.83 73.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.081 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.91 -31.92 72.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.172 -0.955 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -28.19 68.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 109.975 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.425 ' HG2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -68.6 -30.32 69.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.293 -0.88 . . . . 0.0 110.072 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -77.48 -38.46 49.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.201 -1.176 . . . . 0.0 110.386 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 57.0 m -63.48 -38.1 89.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.11 -0.994 . . . . 0.0 110.331 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.84 -41.79 67.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.257 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.65 -43.99 71.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 110.29 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.673 HD21 ' HD2' ' A' ' 18' ' ' TYR . 92.1 mt -67.87 -51.36 49.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.68 -34.46 26.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.157 -0.964 . . . . 0.0 110.005 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' B' ' 21' ' ' GLU . . . -59.64 -58.5 13.95 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.687 ' HD2' HD21 ' A' ' 15' ' ' LEU . 1.3 t80 -47.76 -44.55 28.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -1.016 . . . . 0.0 110.602 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -50.6 -55.7 15.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.047 -1.033 . . . . 0.0 108.878 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.5 t -63.82 -44.38 98.15 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.0 OUTLIER -52.49 -69.01 0.12 Allowed 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.374 0.607 . . . . 0.0 110.734 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.8 t -52.52 -22.73 3.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 O-C-N 121.38 -0.825 . . . . 0.0 110.498 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.8 -21.47 34.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.109 -0.995 . . . . 0.0 110.059 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.28 -56.43 2.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.283 -0.886 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -57.27 -43.68 83.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.158 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.0 OUTLIER 52.84 52.6 10.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.378 -0.826 . . . . 0.0 110.163 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 44.3 Cg_endo -71.05 156.14 60.43 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.639 1.337 . . . . 0.0 110.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.38 -29.63 16.56 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.667 1.351 . . . . 0.0 110.094 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.76 119.43 28.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.365 -0.834 . . . . 0.0 110.109 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.5 -42.03 23.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.239 -0.913 . . . . 0.0 110.254 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.425 HG12 ' HG2' ' A' ' 42' ' ' ARG . 41.1 t -50.66 -59.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.931 . . . . 0.0 110.051 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -62.05 -35.98 80.25 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.59 -0.694 . . . . 0.0 109.971 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 53.2 t80 -65.52 -43.85 88.76 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.309 -0.87 . . . . 0.0 109.656 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.417 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.59 -36.07 71.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.372 -0.83 . . . . 0.0 110.097 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.488 HG13 ' OG1' ' A' ' 39' ' ' THR . 92.4 t -78.02 -44.68 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 O-C-N 121.202 -0.936 . . . . 0.0 110.154 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.69 -30.64 68.92 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.331 -0.856 . . . . 0.0 110.573 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.407 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 74.0 t80 -76.35 -58.32 3.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.129 -0.982 . . . . 0.0 110.367 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -65.58 -42.52 91.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.597 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.541 ' OG1' HG13 ' A' ' 35' ' ' VAL . 53.5 m -55.24 -44.72 75.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.003 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.96 -32.11 72.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.02 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -28.39 68.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.277 -0.89 . . . . 0.0 109.968 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.558 ' HG2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -68.63 -30.09 68.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.286 -0.884 . . . . 0.0 110.195 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.918 . . . . 0.0 110.086 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -73.76 -28.44 61.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.314 -1.109 . . . . 0.0 110.184 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.5 m -71.64 -43.67 65.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.079 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.9 -36.66 62.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -0.875 . . . . 0.0 110.435 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.83 -50.39 35.98 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.895 . . . . 0.0 110.404 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.68 -49.14 72.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.19 -0.944 . . . . 0.0 110.136 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.97 -34.71 60.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.145 -0.972 . . . . 0.0 109.772 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.96 -52.8 46.6 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 108.705 -1.758 . . . . 0.0 108.705 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.588 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -47.67 -37.9 13.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.492 -1.005 . . . . 0.0 110.149 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -65.77 -33.05 74.96 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.585 -0.697 . . . . 0.0 110.335 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.8 t -81.3 -27.28 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 110.687 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -80.79 -56.9 3.82 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.055 -1.028 . . . . 0.0 109.378 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 30' ' ' LEU . 25.8 t -56.7 -31.91 36.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.763 -0.585 . . . . 0.0 110.294 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -75.15 -30.76 60.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.236 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.03 -51.71 4.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.205 -0.934 . . . . 0.0 110.484 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.6 -34.49 67.43 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.224 -0.922 . . . . 0.0 109.961 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.97 71.3 1.53 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.267 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.83 169.74 20.48 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.652 1.343 . . . . 0.0 110.462 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.12 -37.98 7.59 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.734 1.386 . . . . 0.0 110.331 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 33' ' ' PHE . 2.6 t70 -145.37 148.14 33.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.264 -0.898 . . . . 0.0 110.087 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.574 HD21 HG11 ' A' ' 22' ' ' VAL . 1.2 mt -83.71 -41.05 18.12 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.244 -0.91 . . . . 0.0 110.176 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.427 ' O ' HG23 ' A' ' 35' ' ' VAL . 41.2 t -52.13 -63.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.216 -0.928 . . . . 0.0 109.848 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.62 -39.66 85.0 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.539 -0.725 . . . . 0.0 109.882 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.423 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 34.1 t80 -62.83 -51.36 67.35 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 109.783 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.588 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -55.28 -33.88 63.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.387 -0.821 . . . . 0.0 110.004 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.499 HG13 ' OG1' ' B' ' 39' ' ' THR . 68.9 t -75.4 -50.51 23.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.32 -0.862 . . . . 0.0 110.198 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.46 -28.8 70.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.211 -0.93 . . . . 0.0 110.485 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -77.76 -63.08 1.47 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.219 -0.925 . . . . 0.0 110.471 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -58.6 -43.66 89.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.23 -0.919 . . . . 0.0 110.506 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.489 ' OG1' HG13 ' B' ' 35' ' ' VAL . 65.3 m -57.76 -46.24 84.79 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.335 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.04 -21.62 61.51 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.389 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.489 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -77.29 -20.3 55.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.381 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -23.0 43.74 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.227 -0.92 . . . . 0.0 109.758 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.098 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -74.14 -28.39 61.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -1.135 . . . . 0.0 110.136 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.7 m -71.67 -43.69 65.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 110.125 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.83 -36.56 62.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.252 -0.905 . . . . 0.0 110.456 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tp -70.83 -50.44 35.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.175 -0.953 . . . . 0.0 110.336 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.71 -49.14 72.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.95 -34.94 61.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.066 -1.022 . . . . 0.0 109.633 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.67 -53.01 44.5 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.582 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.4 t80 -47.61 -37.96 13.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.459 -1.024 . . . . 0.0 110.097 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.3 m -65.75 -32.93 74.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.584 -0.698 . . . . 0.0 110.401 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 55.8 t -81.3 -27.46 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 110.739 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.57 -57.16 3.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.216 -0.927 . . . . 0.0 109.43 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.554 HG11 HD21 ' B' ' 30' ' ' LEU . 26.1 t -56.45 -31.84 34.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.76 -0.588 . . . . 0.0 110.305 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 47.7 tp -75.31 -30.57 60.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.221 -0.924 . . . . 0.0 110.334 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.18 -51.65 4.33 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 0.0 110.486 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.71 -34.64 67.25 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.27 -0.894 . . . . 0.0 109.797 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.21 71.15 1.56 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.283 -0.885 . . . . 0.0 110.304 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.79 169.82 20.23 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.591 1.311 . . . . 0.0 110.466 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.18 -37.78 7.71 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.691 1.364 . . . . 0.0 110.315 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -145.61 148.05 32.7 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 110.084 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.554 HD21 HG11 ' B' ' 22' ' ' VAL . 1.1 mt -83.59 -41.28 18.03 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.415 ' O ' HG23 ' B' ' 35' ' ' VAL . 41.0 t -51.88 -63.36 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.916 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.68 -39.63 85.15 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.531 -0.731 . . . . 0.0 109.893 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.424 ' CD2' ' CE1' ' B' ' 18' ' ' TYR . 34.2 t80 -62.84 -51.11 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.795 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.582 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -55.53 -33.89 64.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 109.959 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.489 HG13 ' OG1' ' A' ' 39' ' ' THR . 70.3 t -75.41 -50.42 24.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.252 -0.905 . . . . 0.0 110.124 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.6 -28.78 70.13 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.253 -0.904 . . . . 0.0 110.445 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -77.57 -63.37 1.39 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.224 -0.922 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -58.38 -43.83 88.63 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.503 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.499 ' OG1' HG13 ' A' ' 35' ' ' VAL . 64.5 m -57.55 -46.2 84.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 0.0 110.359 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.14 -21.54 61.44 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.201 -0.937 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.498 ' O ' HD23 ' B' ' 41' ' ' LEU . 0.9 OUTLIER -77.52 -20.11 54.75 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.348 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.48 -22.78 43.62 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.225 -0.922 . . . . 0.0 109.763 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.262 -0.899 . . . . 0.0 110.17 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.476 HD11 HG11 ' B' ' 22' ' ' VAL . 1.0 OUTLIER -63.78 -38.73 92.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.235 -1.156 . . . . 0.0 110.146 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 48.4 m -57.75 -56.38 22.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.55 -50.38 53.57 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.439 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.443 ' HA ' HD12 ' A' ' 14' ' ' LEU . 7.8 tp -54.54 -55.52 28.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.46 -51.78 67.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.92 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.64 -30.41 31.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.003 -1.06 . . . . 0.0 109.648 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -58.47 -56.81 23.2 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 179.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.437 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t80 -47.65 -38.17 14.33 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.485 -1.009 . . . . 0.0 110.338 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 1.1 m -64.63 -34.18 77.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.43 -0.793 . . . . 0.0 109.844 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.34 -27.09 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.364 -0.835 . . . . 0.0 110.358 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -82.84 -59.25 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.089 -1.007 . . . . 0.0 108.99 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.49 HG11 ' CD2' ' A' ' 30' ' ' LEU . 43.5 t -55.03 -32.01 26.37 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.827 -0.546 . . . . 0.0 110.522 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 19' ' ' THR . 0.9 OUTLIER -83.73 -22.47 31.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.81 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.74 -58.58 2.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.456 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.44 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -82.92 -22.22 33.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.19 -0.944 . . . . 0.0 110.571 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.8 77.42 0.44 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.106 -0.996 . . . . 0.0 110.004 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 22' ' ' VAL . 44.4 Cg_endo -70.52 153.78 65.18 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.672 1.354 . . . . 0.0 110.574 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.82 -28.14 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.701 1.369 . . . . 0.0 110.441 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.96 125.28 12.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.347 -0.845 . . . . 0.0 110.15 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.49 ' CD2' HG11 ' A' ' 22' ' ' VAL . 1.2 mp -76.82 -31.38 56.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.292 -0.88 . . . . 0.0 109.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.866 HG12 ' HG2' ' B' ' 42' ' ' ARG . 44.8 t -54.3 -61.17 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 109.859 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.24 -45.69 83.61 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.964 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 25' ' ' GLN . 49.4 t80 -58.15 -47.4 83.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 109.87 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.52 -34.98 52.25 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.373 -0.83 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' B' ' 39' ' ' THR . 94.0 t -80.85 -52.46 14.17 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 121.19 -0.944 . . . . 0.0 110.14 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.85 -40.31 66.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.314 -0.866 . . . . 0.0 110.554 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -70.38 -68.22 0.44 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.979 . . . . 0.0 110.347 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.4 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 6.3 m-85 -50.47 -42.42 54.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.549 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.457 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.4 m -58.7 -35.72 73.09 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.103 -0.998 . . . . 0.0 109.855 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.44 -42.22 87.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.292 -0.88 . . . . 0.0 109.952 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.424 ' HA ' HD23 ' A' ' 41' ' ' LEU . 20.1 mt -59.21 -35.55 73.81 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.287 -0.883 . . . . 0.0 109.982 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.708 ' HG2' HG12 ' B' ' 31' ' ' VAL . 3.7 mmm-85 -56.13 -38.42 70.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.43 -0.794 . . . . 0.0 110.066 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.313 -0.867 . . . . 0.0 110.546 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.44 HD11 HG11 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -63.84 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -1.134 . . . . 0.0 110.151 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 47.5 m -57.67 -56.7 18.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.299 -0.876 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.3 -50.56 50.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.336 -0.852 . . . . 0.0 110.418 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.44 ' HA ' HD12 ' B' ' 14' ' ' LEU . 7.8 tp -54.59 -55.35 30.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.878 . . . . 0.0 110.311 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.54 -51.81 67.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.269 -0.894 . . . . 0.0 110.264 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.61 -30.57 32.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.112 -0.992 . . . . 0.0 109.654 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -58.27 -56.77 23.4 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 108.806 -1.717 . . . . 0.0 108.806 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.437 ' O ' HG23 ' B' ' 22' ' ' VAL . 1.1 t80 -47.81 -38.04 14.97 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.365 -1.079 . . . . 0.0 110.322 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' B' ' 23' ' ' LEU . 1.0 OUTLIER -64.77 -33.88 77.03 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.389 -0.819 . . . . 0.0 109.838 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.63 -26.91 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.34 -0.85 . . . . 0.0 110.415 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.7 OUTLIER -83.0 -59.37 2.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.948 . . . . 0.0 108.897 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.49 HG11 ' CD2' ' B' ' 30' ' ' LEU . 43.8 t -54.91 -32.16 26.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.83 -0.543 . . . . 0.0 110.528 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' B' ' 19' ' ' THR . 0.9 OUTLIER -83.51 -22.58 32.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.089 -1.007 . . . . 0.0 110.363 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.61 -58.6 2.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.391 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.431 ' OE1' ' CZ ' ' B' ' 33' ' ' PHE . 0.0 OUTLIER -82.98 -22.29 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.59 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.89 77.44 0.44 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.117 -0.99 . . . . 0.0 109.971 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 22' ' ' VAL . 44.2 Cg_endo -70.66 153.83 64.54 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.717 1.377 . . . . 0.0 110.534 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.85 -28.16 20.34 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 O-C-N 123.838 1.441 . . . . 0.0 110.443 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.98 125.14 12.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.169 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.49 ' CD2' HG11 ' B' ' 22' ' ' VAL . 1.2 mp -76.68 -31.39 57.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.878 . . . . 0.0 110.025 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.708 HG12 ' HG2' ' A' ' 42' ' ' ARG . 43.9 t -54.22 -61.3 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.303 -0.873 . . . . 0.0 109.789 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -65.21 -45.45 84.66 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.431 ' CZ ' ' OE1' ' B' ' 25' ' ' GLN . 49.4 t80 -58.41 -47.41 84.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.849 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.38 -35.05 50.57 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.361 -0.837 . . . . 0.0 110.23 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.457 HG13 ' OG1' ' A' ' 39' ' ' THR . 94.8 t -80.79 -52.64 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.64 -40.41 65.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -70.23 -68.41 0.42 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.071 -1.018 . . . . 0.0 110.294 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -50.47 -42.31 54.21 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' A' ' 35' ' ' VAL . 54.9 m -58.61 -35.86 73.12 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.143 -0.973 . . . . 0.0 109.907 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -42.26 88.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 109.945 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' B' ' 41' ' ' LEU . 20.2 mt -59.26 -35.45 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.302 -0.874 . . . . 0.0 109.953 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.866 ' HG2' HG12 ' A' ' 31' ' ' VAL . 3.7 mmm-85 -56.14 -38.5 70.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.321 -0.862 . . . . 0.0 110.134 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.484 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -75.09 -19.34 60.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -1.168 . . . . 0.0 110.325 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.7 m -69.96 -54.85 11.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.216 -0.928 . . . . 0.0 110.341 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -54.22 -37.12 64.23 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.327 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 14' ' ' LEU . 16.5 mt -63.06 -59.35 4.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.197 -0.939 . . . . 0.0 110.289 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.31 -48.81 80.22 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.353 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.32 -38.64 63.38 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.188 -0.945 . . . . 0.0 109.92 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.83 -52.8 48.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.33 -47.74 36.7 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.388 -1.066 . . . . 0.0 110.094 179.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.8 -40.93 56.65 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.387 -0.821 . . . . 0.0 110.471 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -76.97 -25.29 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.219 -0.926 . . . . 0.0 110.822 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -86.3 -59.08 2.39 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.07 -1.019 . . . . 0.0 109.241 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.41 ' H ' HG23 ' A' ' 22' ' ' VAL . 44.1 t -52.31 -26.71 9.45 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.3 tp -85.41 -38.13 19.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.093 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -53.52 5.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.205 -0.935 . . . . 0.0 110.082 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -61.64 -41.38 97.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 110.104 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 50.03 56.24 17.45 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.337 -0.852 . . . . 0.0 110.375 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.39 155.81 59.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.623 1.328 . . . . 0.0 110.419 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.5 -21.53 25.88 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 O-C-N 123.706 1.372 . . . . 0.0 110.524 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.67 119.48 15.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.281 -0.887 . . . . 0.0 110.321 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.96 -30.23 35.21 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.337 -0.852 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.2 t -51.51 -66.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.187 -0.946 . . . . 0.0 110.063 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.404 ' OD1' ' NH1' ' B' ' 42' ' ' ARG . 1.1 t70 -55.39 -42.76 74.45 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.363 -0.835 . . . . 0.0 109.971 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -58.31 -50.25 74.3 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.826 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.55 64.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.352 -0.843 . . . . 0.0 110.366 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.552 HG13 ' OG1' ' B' ' 39' ' ' THR . 91.6 t -74.04 -46.12 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.179 -0.951 . . . . 0.0 110.26 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.44 -24.22 67.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -73.36 -68.13 0.52 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.233 -0.917 . . . . 0.0 110.391 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.427 ' HB3' HG23 ' B' ' 35' ' ' VAL . 29.9 m-85 -59.33 -50.78 72.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.944 . . . . 0.0 110.389 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.56 ' OG1' HG13 ' B' ' 35' ' ' VAL . 97.8 m -49.97 -33.77 18.81 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.12 -0.988 . . . . 0.0 110.235 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -75.39 -25.28 57.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -38.28 90.2 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' NH1' ' OD1' ' B' ' 32' ' ' ASP . 0.0 OUTLIER -50.54 -40.01 50.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 179.707 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 110.121 179.931 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.388 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -74.97 -19.69 59.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -1.144 . . . . 0.0 110.301 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 74.9 m -69.56 -54.87 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 110.37 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.29 -37.07 64.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.332 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 14' ' ' LEU . 16.6 mt -63.01 -59.57 4.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.291 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.2 -48.66 80.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 110.283 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -53.36 -38.88 63.71 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.019 -1.05 . . . . 0.0 109.916 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.42 -53.15 45.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 108.86 -1.696 . . . . 0.0 108.86 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.12 -47.68 34.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.405 -1.056 . . . . 0.0 110.146 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.9 -40.82 57.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.518 -0.739 . . . . 0.0 110.513 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -77.14 -25.2 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.185 -0.947 . . . . 0.0 110.676 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.6 OUTLIER -86.42 -58.86 2.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.105 -0.997 . . . . 0.0 109.265 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 44.4 t -52.51 -26.64 10.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 121.729 -0.607 . . . . 0.0 110.214 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -85.47 -38.17 18.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.26 -0.9 . . . . 0.0 110.056 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.82 -53.53 5.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.177 -0.952 . . . . 0.0 110.023 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -61.6 -41.63 97.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 109.991 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 50.27 56.19 17.29 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.367 -0.833 . . . . 0.0 110.346 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 155.9 58.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 O-C-N 123.713 1.375 . . . . 0.0 110.459 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.46 -21.51 26.01 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.721 1.379 . . . . 0.0 110.6 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.7 119.35 15.02 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.179 -0.951 . . . . 0.0 110.305 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.93 -30.15 35.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.147 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -51.58 -65.99 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ASP . . . . . 0.406 ' OD1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 t70 -55.35 -42.94 74.53 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.444 -0.785 . . . . 0.0 109.941 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -58.13 -50.36 73.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.242 -0.911 . . . . 0.0 109.897 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.24 -40.29 64.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.396 -0.815 . . . . 0.0 110.426 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.56 HG13 ' OG1' ' A' ' 39' ' ' THR . 93.3 t -74.08 -46.23 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.35 -24.27 67.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.172 -0.955 . . . . 0.0 110.294 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -73.29 -67.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.427 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.42 ' HB3' HG23 ' A' ' 35' ' ' VAL . 29.2 m-85 -59.68 -50.46 73.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.267 -0.895 . . . . 0.0 110.443 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.552 ' OG1' HG13 ' A' ' 35' ' ' VAL . 98.8 m -50.15 -33.83 20.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.074 -1.016 . . . . 0.0 110.205 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -75.27 -25.27 57.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.219 -0.925 . . . . 0.0 109.79 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -38.01 89.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.327 -0.858 . . . . 0.0 109.803 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH1' ' OD1' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -50.88 -39.9 55.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.362 -0.836 . . . . 0.0 110.155 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.35 -0.843 . . . . 0.0 110.234 179.839 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.788 ' O ' HD23 ' A' ' 11' ' ' LEU . 2.9 tt -73.36 -27.26 61.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.191 -1.182 . . . . 0.0 110.29 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 41.2 m -65.22 -47.29 77.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.238 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -57.63 -33.81 68.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 -58.78 4.27 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 73.4 mt -56.55 -41.58 77.11 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.213 -0.929 . . . . 0.0 109.774 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -41.06 59.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.185 -0.947 . . . . 0.0 109.779 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 21' ' ' GLU . . . -56.61 -61.35 7.58 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.652 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 2.2 t80 -48.64 -47.73 40.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.459 -1.024 . . . . 0.0 110.506 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.1 -54.41 25.24 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.092 -1.005 . . . . 0.0 108.879 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.29 -44.86 99.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -51.27 -65.07 0.62 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-O 121.478 0.656 . . . . 0.0 110.685 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 18' ' ' TYR . 21.1 t -54.95 -29.29 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.591 -0.693 . . . . 0.0 110.341 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -72.71 -25.57 61.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.087 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -104.49 -50.47 3.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.227 -0.921 . . . . 0.0 109.996 179.818 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -86.34 50.85 2.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.326 -0.859 . . . . 0.0 110.452 -179.893 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.35 96.09 0.11 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.826 -0.546 . . . . 0.0 111.121 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.414 ' CD ' ' O ' ' A' ' 25' ' ' GLN . 48.2 Cg_endo -89.92 153.42 4.93 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 124.004 1.529 . . . . 0.0 110.804 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.06 -27.93 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.694 1.365 . . . . 0.0 109.812 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.44 115.8 11.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.488 -0.758 . . . . 0.0 109.839 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.72 -38.26 83.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.261 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.8 t -53.6 -65.72 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.174 -0.954 . . . . 0.0 109.866 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -56.98 -34.73 68.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.359 -0.838 . . . . 0.0 109.964 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.471 ' HD2' ' HH ' ' A' ' 18' ' ' TYR . 64.9 t80 -66.75 -44.32 81.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 0.0 109.675 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.652 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -62.55 -30.56 71.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.314 -0.866 . . . . 0.0 109.958 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.402 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.8 t -76.55 -48.41 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.337 -0.852 . . . . 0.0 110.165 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.18 -26.3 64.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.477 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -78.25 -68.47 0.64 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.127 -0.983 . . . . 0.0 110.525 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -56.93 -45.3 82.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.237 -0.915 . . . . 0.0 110.528 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.42 ' OG1' HG13 ' B' ' 35' ' ' VAL . 99.7 m -53.55 -43.98 68.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.082 -1.011 . . . . 0.0 110.024 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -66.12 -32.08 73.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.323 -0.861 . . . . 0.0 110.116 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -64.9 -40.07 94.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.025 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -39.42 90.16 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.336 -0.852 . . . . 0.0 110.296 -179.947 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.788 ' O ' HD23 ' B' ' 11' ' ' LEU . 2.9 tt -73.34 -27.28 61.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.229 -1.16 . . . . 0.0 110.299 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 39.9 m -65.22 -47.38 77.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.281 -0.887 . . . . 0.0 110.267 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -57.55 -33.93 68.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.86 -59.04 3.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 110.08 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -56.28 -41.68 76.26 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 109.801 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -40.93 59.74 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.077 -1.014 . . . . 0.0 109.891 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' B' ' 21' ' ' GLU . . . -56.55 -61.47 7.44 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.649 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 2.2 t80 -48.63 -47.83 39.93 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.392 -1.064 . . . . 0.0 110.517 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.02 -54.5 24.02 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.147 -0.971 . . . . 0.0 108.886 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.19 -44.71 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.2 OUTLIER -51.43 -64.98 0.64 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.564 0.697 . . . . 0.0 110.707 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.494 HG23 ' O ' ' B' ' 18' ' ' TYR . 21.1 t -54.99 -29.39 21.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.424 -0.798 . . . . 0.0 110.296 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -25.52 61.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.161 -0.962 . . . . 0.0 110.089 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.414 ' N ' ' HD2' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -104.62 -50.55 3.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.957 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.415 ' O ' ' N ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER -86.28 50.75 2.05 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.37 -0.831 . . . . 0.0 110.468 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.25 95.98 0.1 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.83 -0.543 . . . . 0.0 111.14 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.415 ' N ' ' O ' ' B' ' 25' ' ' GLN . 48.3 Cg_endo -89.86 153.48 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 124.014 1.534 . . . . 0.0 110.803 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.04 -28.12 19.58 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.733 1.386 . . . . 0.0 109.88 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.21 115.85 12.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.433 -0.792 . . . . 0.0 109.778 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.66 -38.34 83.64 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.4 t -53.63 -65.6 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -0.959 . . . . 0.0 109.929 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.08 -34.58 68.45 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.507 -0.745 . . . . 0.0 109.983 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.457 ' HD2' ' HH ' ' B' ' 18' ' ' TYR . 65.5 t80 -66.98 -43.85 81.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.649 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -62.89 -30.54 71.61 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.32 -0.862 . . . . 0.0 109.948 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.42 HG13 ' OG1' ' A' ' 39' ' ' THR . 87.8 t -76.43 -48.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.368 -0.833 . . . . 0.0 110.178 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -59.11 -26.4 64.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 110.473 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -78.12 -68.17 0.66 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.588 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -57.29 -45.43 84.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.206 -0.933 . . . . 0.0 110.426 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.409 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 99.7 m -53.43 -43.85 68.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.099 -1.001 . . . . 0.0 110.079 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -66.23 -31.98 73.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.091 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.03 -39.86 94.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.251 -0.906 . . . . 0.0 110.038 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -39.51 90.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 110.151 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.265 -179.967 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.11 -52.98 19.43 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 110.407 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.1 m -60.76 -49.95 75.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.877 . . . . 0.0 110.401 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.67 -45.57 66.84 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.324 -0.86 . . . . 0.0 110.407 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 14' ' ' LEU . 2.1 mt -56.08 -53.56 55.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.168 -0.957 . . . . 0.0 110.341 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.49 HD21 ' HD2' ' B' ' 18' ' ' TYR . 66.7 mt -62.73 -47.82 81.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.21 -0.931 . . . . 0.0 110.08 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.58 -34.55 58.75 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.236 -0.915 . . . . 0.0 109.719 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.77 -55.28 30.85 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.435 ' HD2' HD21 ' B' ' 15' ' ' LEU . 1.6 t80 -47.39 -43.66 23.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.504 -0.998 . . . . 0.0 110.404 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.4 m -55.9 -36.12 67.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.431 -0.793 . . . . 0.0 110.265 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.7 t -82.41 -25.35 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 110.543 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.8 mt-10 -85.32 -54.12 4.8 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.13 -0.981 . . . . 0.0 108.886 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.9 t -53.75 -39.15 37.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 CA-C-O 121.219 0.533 . . . . 0.0 110.308 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.508 HD12 ' O ' ' A' ' 19' ' ' THR . 12.1 mt -70.99 -40.4 71.88 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -65.42 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.236 -0.915 . . . . 0.0 110.242 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.13 65.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.177 -0.952 . . . . 0.0 110.081 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.96 58.58 16.81 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.318 -0.864 . . . . 0.0 110.566 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.54 146.89 50.63 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.627 1.33 . . . . 0.0 110.303 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.66 -30.77 17.6 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.63 1.332 . . . . 0.0 110.536 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -133.6 121.21 21.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 110.241 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.5 -25.04 41.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.065 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.679 HG12 ' HD2' ' B' ' 42' ' ' ARG . 41.0 t -54.34 -53.71 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.211 -0.931 . . . . 0.0 109.793 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.38 -47.44 60.9 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.584 -0.697 . . . . 0.0 109.934 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -58.13 -50.51 73.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.224 -0.922 . . . . 0.0 109.577 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.464 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -53.78 -37.35 63.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.306 -0.871 . . . . 0.0 109.921 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.507 HG13 ' OG1' ' B' ' 39' ' ' THR . 68.8 t -79.31 -34.89 16.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.34 -0.85 . . . . 0.0 109.915 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.76 -22.75 49.76 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -79.76 -64.01 1.28 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.176 -0.952 . . . . 0.0 110.623 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.482 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 15.4 m-85 -59.43 -48.07 83.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.198 -0.939 . . . . 0.0 110.533 -179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.517 ' OG1' HG13 ' B' ' 35' ' ' VAL . 62.3 m -52.48 -50.57 62.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.041 -1.037 . . . . 0.0 110.052 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -58.79 -26.7 64.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.157 -0.965 . . . . 0.0 109.832 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -61.63 -40.9 96.5 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.4 -0.813 . . . . 0.0 110.12 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.646 ' HD2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -52.55 -63.06 1.26 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.907 . . . . 0.0 110.241 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 tp -70.16 -52.81 20.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.093 -1.24 . . . . 0.0 110.422 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 85.7 m -60.86 -49.83 75.88 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.167 -0.958 . . . . 0.0 110.308 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.79 -45.54 67.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.0 110.37 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 14' ' ' LEU . 2.1 mt -56.1 -53.73 53.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.294 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.435 HD21 ' HD2' ' A' ' 18' ' ' TYR . 66.4 mt -62.63 -47.89 81.77 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.912 . . . . 0.0 110.022 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.55 -34.63 58.92 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.15 -0.969 . . . . 0.0 109.659 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.69 -55.29 30.74 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.85 -1.7 . . . . 0.0 108.85 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.49 ' HD2' HD21 ' A' ' 15' ' ' LEU . 1.6 t80 -47.43 -43.56 23.95 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.375 -1.074 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.512 ' O ' HD12 ' B' ' 23' ' ' LEU . 2.4 m -56.09 -35.92 67.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.531 -0.731 . . . . 0.0 110.254 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.46 -25.53 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.26 -0.9 . . . . 0.0 110.476 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.421 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 1.8 mt-10 -85.22 -54.06 4.85 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 108.877 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 95.6 t -53.82 -39.04 37.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.859 -0.526 . . . . 0.0 110.249 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.512 HD12 ' O ' ' B' ' 19' ' ' THR . 12.2 mt -71.1 -40.53 71.45 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.235 -0.915 . . . . 0.0 110.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.04 -65.48 0.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 110.266 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.26 -31.09 65.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.203 -0.936 . . . . 0.0 110.015 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.93 58.56 16.83 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.525 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.37 146.96 51.73 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.691 1.364 . . . . 0.0 110.339 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.71 -31.01 17.04 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.685 1.361 . . . . 0.0 110.52 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -133.43 121.34 22.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.274 -0.891 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.52 -25.16 41.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 110.067 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.646 HG12 ' HD2' ' A' ' 42' ' ' ARG . 41.6 t -54.22 -53.73 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.768 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.42 -47.37 61.05 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.598 -0.689 . . . . 0.0 109.952 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -58.2 -50.33 73.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 109.619 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.482 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -53.87 -37.51 63.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.345 -0.847 . . . . 0.0 109.881 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.517 HG13 ' OG1' ' A' ' 39' ' ' THR . 72.2 t -79.13 -34.78 16.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 O-C-N 121.341 -0.85 . . . . 0.0 110.019 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.94 -22.64 49.23 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.314 -0.866 . . . . 0.0 109.669 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -79.75 -64.24 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.218 -0.926 . . . . 0.0 110.586 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.464 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 15.2 m-85 -59.21 -47.98 83.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.184 -0.947 . . . . 0.0 110.683 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.507 ' OG1' HG13 ' A' ' 35' ' ' VAL . 61.0 m -52.76 -50.37 63.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.956 -1.09 . . . . 0.0 110.051 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -59.0 -26.65 64.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.857 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -61.67 -40.87 96.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 110.04 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.679 ' HD2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -52.45 -63.21 1.22 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.283 -0.886 . . . . 0.0 110.193 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.16 -29.16 70.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 110.214 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.9 m -56.77 -45.73 81.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.9 . . . . 0.0 110.123 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 -36.92 79.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -0.846 . . . . 0.0 110.366 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.33 -47.9 53.72 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.2 -0.938 . . . . 0.0 110.232 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.41 ' HA ' HD13 ' A' ' 15' ' ' LEU . 0.7 OUTLIER -65.36 -58.2 6.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.075 -1.015 . . . . 0.0 110.102 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.4 -24.69 5.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.155 -0.966 . . . . 0.0 109.903 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -65.94 -57.41 10.89 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.6 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t80 -48.54 -35.8 14.07 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.384 -1.068 . . . . 0.0 110.312 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.01 -39.17 93.96 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.42 -0.8 . . . . 0.0 110.065 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.423 ' O ' ' CB ' ' A' ' 24' ' ' ARG . 92.2 t -80.88 -21.52 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 110.798 -179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.4 OUTLIER -86.95 -55.05 4.01 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.065 -1.022 . . . . 0.0 109.333 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 18' ' ' TYR . 29.0 t -56.85 -31.18 35.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.722 -0.611 . . . . 0.0 110.389 -179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.454 ' HA ' HD23 ' A' ' 23' ' ' LEU . 32.4 mt -87.43 -42.0 13.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.218 -0.926 . . . . 0.0 110.34 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -71.9 -53.27 13.69 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.143 -0.973 . . . . 0.0 110.262 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.31 -35.35 63.66 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.191 -0.943 . . . . 0.0 109.855 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.3 64.07 8.97 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.476 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.39 151.29 65.38 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.741 1.39 . . . . 0.0 110.527 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.36 -22.52 25.05 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.733 1.386 . . . . 0.0 110.272 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.73 116.31 14.75 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.261 -0.9 . . . . 0.0 110.13 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.538 HD11 ' CE2' ' A' ' 18' ' ' TYR . 7.5 tp -80.53 -34.2 35.73 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 110.307 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 31' ' ' VAL . 48.4 t -51.67 -66.21 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.208 -0.932 . . . . 0.0 110.142 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.15 -40.5 67.49 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.428 -0.795 . . . . 0.0 109.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.9 -54.98 38.44 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.36 -0.838 . . . . 0.0 109.763 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.519 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -53.0 -38.55 62.4 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.575 HG13 ' OG1' ' B' ' 39' ' ' THR . 81.6 t -77.37 -27.09 15.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.293 -0.879 . . . . 0.0 109.837 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.99 -51.94 7.54 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.334 -0.854 . . . . 0.0 109.868 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -56.71 -63.17 1.29 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 110.786 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CG ' ' HB1' ' B' ' 34' ' ' ALA . 15.9 m-85 -53.89 -52.31 60.93 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 111.008 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.584 ' OG1' HG13 ' B' ' 35' ' ' VAL . 22.3 m -53.36 -24.93 13.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.933 -1.104 . . . . 0.0 110.086 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -25.56 43.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.929 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.6 -25.35 60.29 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.04 -29.1 64.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.262 -0.899 . . . . 0.0 109.629 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.32 -0.862 . . . . 0.0 110.184 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.1 -29.32 70.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -1.148 . . . . 0.0 110.212 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 93.9 m -56.66 -45.68 81.5 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.249 -0.907 . . . . 0.0 110.239 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -36.79 79.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.364 -0.835 . . . . 0.0 110.281 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.53 -47.79 52.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.273 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -65.27 -58.2 6.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 110.214 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.52 -24.65 5.45 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.21 -0.931 . . . . 0.0 109.858 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -65.81 -57.61 10.67 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.598 ' O ' HG23 ' B' ' 22' ' ' VAL . 1.1 t80 -48.44 -35.85 13.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.423 -1.045 . . . . 0.0 110.394 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.02 -39.19 94.02 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.479 -0.763 . . . . 0.0 110.039 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' B' ' 24' ' ' ARG . 92.9 t -80.76 -21.57 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.952 . . . . 0.0 110.825 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.4 OUTLIER -86.97 -55.14 3.96 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.014 -1.053 . . . . 0.0 109.269 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.598 HG23 ' O ' ' B' ' 18' ' ' TYR . 29.1 t -56.79 -31.07 34.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.716 -0.615 . . . . 0.0 110.475 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' B' ' 23' ' ' LEU . 32.0 mt -87.51 -42.14 12.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.0 110.29 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.419 ' CB ' ' O ' ' B' ' 20' ' ' VAL . 0.2 OUTLIER -71.88 -53.2 13.93 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 110.241 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.29 -35.4 63.72 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.202 -0.936 . . . . 0.0 109.763 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.28 64.14 8.86 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.323 -0.861 . . . . 0.0 110.441 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.56 151.32 64.42 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.675 1.355 . . . . 0.0 110.449 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.41 -22.36 25.08 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.714 1.376 . . . . 0.0 110.313 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.81 116.4 14.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 110.067 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.536 HD11 ' CE2' ' B' ' 18' ' ' TYR . 7.7 tp -80.67 -34.32 34.89 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.365 -0.835 . . . . 0.0 110.261 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.403 ' H ' HG23 ' B' ' 31' ' ' VAL . 48.5 t -51.59 -66.33 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.271 -0.893 . . . . 0.0 110.038 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.03 -40.57 67.19 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.543 -0.723 . . . . 0.0 109.831 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -60.79 -55.09 37.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.409 -0.807 . . . . 0.0 109.688 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.514 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.96 -38.25 61.89 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.395 -0.816 . . . . 0.0 109.997 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.584 HG13 ' OG1' ' A' ' 39' ' ' THR . 81.1 t -77.73 -26.76 15.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 O-C-N 121.248 -0.907 . . . . 0.0 109.838 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -82.3 -51.96 7.39 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.275 -0.891 . . . . 0.0 109.772 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -56.85 -63.01 1.35 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 0.0 110.715 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -54.15 -52.1 62.2 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.926 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.575 ' OG1' HG13 ' A' ' 35' ' ' VAL . 22.4 m -53.37 -25.2 14.49 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.08 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -25.91 43.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 109.84 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.14 -25.41 60.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.242 -0.911 . . . . 0.0 110.03 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -28.99 64.73 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.371 -0.83 . . . . 0.0 109.672 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.199 -179.948 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.54 -27.1 60.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.257 -1.143 . . . . 0.0 110.239 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.09 -61.64 2.31 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.57 -48.37 57.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 0.0 110.371 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.68 -57.91 10.01 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.291 -0.88 . . . . 0.0 110.153 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -60.69 -38.55 85.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -54.09 -42.85 69.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.091 -1.005 . . . . 0.0 109.754 179.7 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.417 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -56.49 -56.23 25.58 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.844 -1.702 . . . . 0.0 108.844 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.635 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -47.09 -45.86 22.31 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.467 -1.019 . . . . 0.0 110.423 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -61.22 -32.89 72.67 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -0.767 . . . . 0.0 109.86 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 16' ' ' GLN . 48.0 t -82.72 -26.99 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.871 . . . . 0.0 110.664 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -80.12 -59.21 2.8 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.089 -1.007 . . . . 0.0 109.016 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.47 HG11 HD21 ' B' ' 11' ' ' LEU . 20.7 t -54.93 -32.94 27.51 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.883 -0.511 . . . . 0.0 109.8 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.26 -19.86 42.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.082 -1.011 . . . . 0.0 110.215 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.15 -49.45 8.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -0.921 . . . . 0.0 110.504 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.437 ' CG ' ' HD3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -99.99 -23.59 14.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.22 -0.925 . . . . 0.0 110.678 -179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 49.67 71.04 1.7 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.437 ' HD3' ' CG ' ' A' ' 25' ' ' GLN . 44.6 Cg_endo -71.2 154.09 61.96 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.679 1.357 . . . . 0.0 110.379 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.02 -42.14 3.37 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.358 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -110.16 114.64 28.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.26 -0.9 . . . . 0.0 110.152 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.17 -33.75 22.23 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.866 . . . . 0.0 109.93 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.9 t -52.9 -64.79 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 0.0 109.799 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.532 -0.73 . . . . 0.0 109.828 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -53.96 -47.1 71.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.842 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.635 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.34 -46.94 66.3 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.316 -0.865 . . . . 0.0 109.945 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.466 HG23 ' HB3' ' B' ' 38' ' ' PHE . 94.8 t -62.76 -49.12 84.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 O-C-N 121.206 -0.934 . . . . 0.0 109.871 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.42 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -51.28 -56.48 12.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.383 -0.823 . . . . 0.0 110.531 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -53.35 -63.81 1.03 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.452 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 22.8 m-85 -58.29 -53.45 58.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 110.479 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 90.3 m -51.52 -33.66 32.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.138 -0.976 . . . . 0.0 110.164 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.87 -29.83 44.7 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.0 109.979 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.62 -34.79 69.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 110.086 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -31.5 69.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.262 -0.899 . . . . 0.0 110.162 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.206 -0.934 . . . . 0.0 110.204 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -74.59 -27.08 60.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -1.149 . . . . 0.0 110.19 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.04 -61.88 2.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.226 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.34 -48.32 55.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.824 . . . . 0.0 110.454 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.72 -58.02 9.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.55 -38.44 84.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.307 -0.871 . . . . 0.0 110.314 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.598 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -54.24 -42.81 70.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.059 -1.025 . . . . 0.0 109.76 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.418 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -56.6 -56.16 26.06 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.636 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.4 t80 -47.16 -45.79 23.04 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.519 -0.989 . . . . 0.0 110.4 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -61.33 -32.66 72.54 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.52 -0.737 . . . . 0.0 109.963 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.598 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.2 t -82.78 -27.1 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 110.599 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' B' ' 17' ' ' GLY . 1.0 OUTLIER -80.06 -59.24 2.79 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.133 -0.979 . . . . 0.0 109.083 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.476 HG23 ' O ' ' B' ' 18' ' ' TYR . 20.5 t -54.97 -32.71 27.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.801 -0.562 . . . . 0.0 109.857 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.51 -19.79 41.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 0.0 110.134 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -49.48 8.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.252 -0.905 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.435 ' CG ' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -99.98 -23.69 14.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.24 -0.912 . . . . 0.0 110.671 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 49.75 70.97 1.73 Allowed Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.079 -1.013 . . . . 0.0 110.519 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.435 ' HD3' ' CG ' ' B' ' 25' ' ' GLN . 44.4 Cg_endo -71.16 153.93 62.21 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.689 1.363 . . . . 0.0 110.364 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.99 -42.02 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 123.672 1.354 . . . . 0.0 110.299 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -110.36 114.5 28.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.908 . . . . 0.0 110.13 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.99 -33.84 22.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.229 -0.919 . . . . 0.0 109.969 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.0 t -52.82 -64.76 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.327 -0.858 . . . . 0.0 109.837 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.87 -45.86 82.22 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -54.13 -47.2 72.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.245 -0.909 . . . . 0.0 109.807 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.636 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.26 -46.83 65.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 0.0 109.969 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 38' ' ' PHE . 99.3 t -62.96 -49.0 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.278 -0.889 . . . . 0.0 109.873 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.423 ' OE1' ' N ' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -51.32 -56.47 12.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.477 -0.764 . . . . 0.0 110.519 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -53.25 -64.18 0.9 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.0 110.424 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.479 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 23.1 m-85 -58.01 -53.28 60.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.205 -0.935 . . . . 0.0 110.534 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.425 ' OG1' HG13 ' A' ' 35' ' ' VAL . 89.5 m -51.69 -33.63 34.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.075 -1.016 . . . . 0.0 110.113 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -29.88 44.35 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.273 -0.892 . . . . 0.0 110.024 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.45 -35.06 69.65 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.856 . . . . 0.0 110.071 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.73 -31.63 69.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.264 -0.897 . . . . 0.0 110.14 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.252 -179.891 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -32.47 49.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -1.126 . . . . 0.0 110.371 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -59.47 -56.09 26.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.95 . . . . 0.0 110.261 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -51.93 -30.08 22.95 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.366 -0.834 . . . . 0.0 110.383 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.6 tp -69.85 -56.94 5.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.155 -0.966 . . . . 0.0 110.174 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.84 -46.06 89.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.163 -0.961 . . . . 0.0 110.191 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.76 -33.86 50.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.257 -0.902 . . . . 0.0 109.881 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -61.16 -57.63 17.53 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.544 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.1 t80 -45.13 -35.89 3.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.897 . . . . 0.0 110.711 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.665 ' O ' HD23 ' A' ' 23' ' ' LEU . 31.9 m -67.98 -35.1 77.79 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.825 . . . . 0.0 109.952 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.43 -24.38 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.218 -0.926 . . . . 0.0 110.4 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -76.9 -56.71 4.36 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.07 -1.019 . . . . 0.0 108.679 179.501 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 18' ' ' TYR . 46.0 t -56.35 -35.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 121.188 0.518 . . . . 0.0 110.245 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.665 HD23 ' O ' ' A' ' 19' ' ' THR . 3.8 mm? -73.73 -23.11 59.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.255 -0.903 . . . . 0.0 110.377 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.17 -65.39 1.02 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.249 -0.907 . . . . 0.0 110.764 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.79 -29.11 55.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.162 -0.961 . . . . 0.0 110.574 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 53.08 76.81 0.49 Allowed Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 0.0 110.055 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.97 156.69 55.93 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.727 1.382 . . . . 0.0 110.558 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.17 -33.5 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.769 1.405 . . . . 0.0 110.404 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -127.86 116.03 19.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.349 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.419 HD11 ' CE2' ' A' ' 18' ' ' TYR . 11.4 tp -74.35 -44.68 51.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.328 -0.858 . . . . 0.0 110.059 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.436 ' H ' HG23 ' A' ' 31' ' ' VAL . 43.1 t -50.61 -60.85 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.367 -0.833 . . . . 0.0 109.896 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.86 -37.92 77.59 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.629 -0.669 . . . . 0.0 109.945 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 27.8 t80 -62.57 -51.61 66.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.28 -0.888 . . . . 0.0 109.699 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.528 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -36.76 56.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.494 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.7 t -73.94 -51.55 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 O-C-N 121.207 -0.933 . . . . 0.0 110.173 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.24 -29.82 69.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.195 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.428 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 74.5 t80 -78.24 -67.39 0.74 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.283 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -51.69 -44.53 63.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.275 -0.89 . . . . 0.0 110.309 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.479 ' OG1' HG13 ' B' ' 35' ' ' VAL . 47.4 m -54.62 -44.56 73.24 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.724 179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -71.49 -27.15 63.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.332 -0.855 . . . . 0.0 109.814 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.856 . . . . 0.0 110.027 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.67 -26.71 60.03 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.284 -0.885 . . . . 0.0 109.848 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 110.485 179.82 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.45 -32.48 48.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.201 -1.176 . . . . 0.0 110.41 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.2 m -59.4 -56.17 25.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.167 -0.958 . . . . 0.0 110.327 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.9 -29.86 21.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.321 -0.862 . . . . 0.0 110.463 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.11 -56.79 5.99 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.98 -45.93 90.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.936 . . . . 0.0 110.187 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.79 -34.08 51.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.312 -0.867 . . . . 0.0 109.846 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -61.25 -57.53 17.9 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.542 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 2.1 t80 -45.01 -36.12 3.28 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.566 -0.961 . . . . 0.0 110.623 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.649 ' O ' HD23 ' B' ' 23' ' ' LEU . 33.6 m -67.77 -35.14 78.16 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.437 -0.789 . . . . 0.0 110.04 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.45 -24.39 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.236 -0.915 . . . . 0.0 110.399 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.445 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -76.89 -56.65 4.4 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.184 -0.948 . . . . 0.0 108.698 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 18' ' ' TYR . 46.3 t -56.29 -36.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 121.206 0.526 . . . . 0.0 110.188 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.649 HD23 ' O ' ' B' ' 19' ' ' THR . 3.8 mm? -73.51 -23.0 59.97 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.32 -65.36 1.02 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.211 -0.931 . . . . 0.0 110.71 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.89 -28.94 55.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.175 -0.953 . . . . 0.0 110.659 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 52.98 76.95 0.48 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.109 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.11 156.68 55.39 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.765 1.403 . . . . 0.0 110.637 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.12 -33.37 11.74 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.779 1.41 . . . . 0.0 110.448 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -128.12 116.12 19.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 110.259 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.42 HD11 ' CE2' ' B' ' 18' ' ' TYR . 11.4 tp -74.47 -44.66 50.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.217 -0.927 . . . . 0.0 110.023 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.422 HG23 ' H ' ' B' ' 31' ' ' VAL . 43.9 t -50.74 -60.88 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.242 -0.911 . . . . 0.0 109.859 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.61 -37.9 76.84 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.584 -0.698 . . . . 0.0 109.853 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.41 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 27.9 t80 -62.87 -51.35 67.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.304 -0.872 . . . . 0.0 109.654 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.542 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.84 -36.5 58.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.001 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.479 HG13 ' OG1' ' A' ' 39' ' ' THR . 95.6 t -74.18 -51.55 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.262 -0.898 . . . . 0.0 110.059 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.31 -29.39 68.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.253 -0.904 . . . . 0.0 110.377 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.445 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 74.4 t80 -78.53 -67.27 0.76 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.186 -0.946 . . . . 0.0 110.261 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -51.8 -44.54 63.52 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.494 ' OG1' HG13 ' A' ' 35' ' ' VAL . 47.1 m -54.5 -44.53 72.79 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.161 -0.962 . . . . 0.0 109.717 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -71.84 -26.81 62.52 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 109.83 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -63.09 -25.26 68.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 110.037 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.84 -26.68 59.87 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 109.744 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 110.448 179.832 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.506 HD23 ' C ' ' A' ' 11' ' ' LEU . 9.7 tt -75.04 -32.33 61.53 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -1.102 . . . . 0.0 110.094 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.2 m -62.67 -49.47 75.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.0 110.126 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -54.75 -49.96 69.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 110.257 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.85 -50.0 70.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.353 -0.842 . . . . 0.0 110.327 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.487 HD13 ' HA ' ' A' ' 15' ' ' LEU . 1.5 mm? -56.1 -52.44 64.29 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 110.177 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.464 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -52.28 -33.71 43.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.127 -0.983 . . . . 0.0 109.804 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.425 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.88 -55.45 30.49 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 108.803 -1.719 . . . . 0.0 108.803 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.453 ' CE2' HD11 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -49.78 -45.43 49.72 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.366 -1.079 . . . . 0.0 110.396 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 85.3 m -59.08 -35.77 73.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.401 -0.812 . . . . 0.0 110.069 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 16' ' ' GLN . 85.4 t -76.66 -27.06 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.484 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -85.23 -64.22 1.19 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.2 -0.937 . . . . 0.0 109.338 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.408 ' H ' HG23 ' A' ' 22' ' ' VAL . 39.3 t -50.55 -25.76 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.752 -0.592 . . . . 0.0 110.451 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 19' ' ' THR . 19.6 tp -88.36 -25.64 22.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.244 -0.91 . . . . 0.0 110.205 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.64 -56.38 3.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.159 -0.963 . . . . 0.0 110.529 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 26' ' ' GLN . 5.9 pt20 -85.32 -27.03 26.19 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.075 -1.016 . . . . 0.0 110.581 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.463 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.3 OUTLIER 47.87 80.68 0.28 Allowed Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 0.0 110.632 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.74 161.66 44.46 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.622 1.327 . . . . 0.0 110.547 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.3 -36.02 7.64 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.736 1.387 . . . . 0.0 110.236 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -130.08 113.8 14.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.308 -0.87 . . . . 0.0 110.001 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.453 HD11 ' CE2' ' A' ' 18' ' ' TYR . 4.3 tp -67.2 -36.56 81.99 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.0 110.367 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.417 ' H ' HG23 ' A' ' 31' ' ' VAL . 44.0 t -51.3 -65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.216 -0.927 . . . . 0.0 110.091 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.24 -40.87 68.14 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.527 -0.733 . . . . 0.0 109.997 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.5 -46.71 89.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.771 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.666 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -57.78 -44.44 86.23 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.145 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.574 HG13 ' OG1' ' B' ' 39' ' ' THR . 99.0 t -69.91 -34.49 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.301 -0.874 . . . . 0.0 110.021 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.5 40.12 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.279 -0.888 . . . . 0.0 109.751 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 16.1 t80 -76.58 -68.48 0.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.158 -0.964 . . . . 0.0 110.291 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.679 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 17.2 m-85 -51.67 -50.31 60.67 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.224 -0.922 . . . . 0.0 110.575 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.576 ' OG1' HG13 ' B' ' 35' ' ' VAL . 51.8 m -53.14 -39.07 63.24 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.949 -1.094 . . . . 0.0 110.054 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -73.01 -27.21 61.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.33 -0.856 . . . . 0.0 109.989 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.76 -35.47 76.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.358 -0.839 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.1 -38.2 70.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.268 -0.895 . . . . 0.0 110.222 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.223 -0.923 . . . . 0.0 110.576 -179.926 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.487 ' C ' HD23 ' B' ' 11' ' ' LEU . 9.8 tt -75.06 -32.32 61.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.326 -1.102 . . . . 0.0 110.113 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.8 m -62.58 -49.5 75.0 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.344 -0.848 . . . . 0.0 110.15 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -54.73 -49.97 69.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.848 . . . . 0.0 110.267 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.84 -50.13 70.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.264 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.448 ' HA ' HD13 ' B' ' 15' ' ' LEU . 1.5 mm? -56.02 -52.61 63.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.46 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.2 OUTLIER -51.97 -33.99 40.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.11 -0.994 . . . . 0.0 109.856 179.635 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -57.61 -55.6 29.59 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.88 -1.688 . . . . 0.0 108.88 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.469 ' CE2' HD11 ' B' ' 30' ' ' LEU . 1.0 OUTLIER -49.7 -45.53 49.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.417 -1.049 . . . . 0.0 110.395 179.535 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 84.8 m -58.94 -35.63 73.43 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.418 -0.801 . . . . 0.0 110.072 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.46 HG23 ' O ' ' B' ' 16' ' ' GLN . 83.9 t -76.92 -26.92 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.274 -0.891 . . . . 0.0 110.417 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.444 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -85.29 -64.21 1.19 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.109 -0.995 . . . . 0.0 109.357 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.423 HG23 ' H ' ' B' ' 22' ' ' VAL . 39.2 t -50.57 -25.68 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.716 -0.615 . . . . 0.0 110.329 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.414 ' CB ' ' O ' ' B' ' 19' ' ' THR . 19.9 tp -88.57 -25.53 22.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.118 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.83 -56.32 3.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.167 -0.958 . . . . 0.0 110.494 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.447 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 6.0 pt20 -85.36 -26.94 26.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.153 -0.967 . . . . 0.0 110.596 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.447 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 0.3 OUTLIER 47.86 80.65 0.28 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.177 -0.952 . . . . 0.0 110.524 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.414 ' HD3' ' HG3' ' B' ' 25' ' ' GLN . 45.7 Cg_endo -71.65 161.54 44.94 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.791 1.416 . . . . 0.0 110.567 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -36.09 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.67 1.353 . . . . 0.0 110.212 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -129.86 113.88 15.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -0.894 . . . . 0.0 110.001 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.469 HD11 ' CE2' ' B' ' 18' ' ' TYR . 4.3 tp -67.21 -36.51 81.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 110.374 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.41 HG23 ' H ' ' B' ' 31' ' ' VAL . 43.8 t -51.34 -65.4 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.255 -0.903 . . . . 0.0 110.09 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.52 -40.57 68.73 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.437 -0.79 . . . . 0.0 109.923 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -60.55 -47.0 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.22 -0.925 . . . . 0.0 109.755 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.679 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -57.36 -44.46 84.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.264 -0.898 . . . . 0.0 110.252 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.576 HG13 ' OG1' ' A' ' 39' ' ' THR . 98.1 t -70.06 -34.48 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.204 -0.935 . . . . 0.0 109.987 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.58 40.14 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.359 -0.838 . . . . 0.0 109.748 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.444 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 16.2 t80 -76.42 -68.44 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.981 . . . . 0.0 110.383 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.666 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 17.4 m-85 -51.84 -50.2 61.36 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.547 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.574 ' OG1' HG13 ' A' ' 35' ' ' VAL . 51.8 m -53.21 -38.99 63.38 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.082 -1.011 . . . . 0.0 110.047 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -73.08 -27.24 61.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.946 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -35.5 76.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.339 -0.851 . . . . 0.0 110.11 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.07 -38.34 70.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.174 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.64 -179.897 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.759 HD11 HG11 ' B' ' 22' ' ' VAL . 0.2 OUTLIER -86.34 -19.74 29.34 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 0.0 110.312 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.3 m -77.04 -45.64 26.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.237 -0.914 . . . . 0.0 110.286 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -55.05 -57.35 12.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.304 -0.872 . . . . 0.0 110.121 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.03 -54.03 41.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 110.238 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.867 . . . . 0.0 110.244 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.26 -40.03 73.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.145 -0.972 . . . . 0.0 109.787 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.55 -53.65 39.91 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.624 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -48.49 -48.72 37.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.426 -1.044 . . . . 0.0 110.209 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 51.8 m -54.5 -32.5 58.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.474 -0.766 . . . . 0.0 110.221 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.19 -24.62 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.229 -0.919 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.48 ' OE2' ' CE1' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -88.65 -58.55 2.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.743 HG11 HD11 ' B' ' 11' ' ' LEU . 50.4 t -50.59 -41.12 20.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.735 -0.603 . . . . 0.0 110.364 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.2 -34.76 59.29 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.133 -0.98 . . . . 0.0 110.186 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.34 -49.45 14.93 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 110.324 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.09 -37.06 58.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.211 -0.93 . . . . 0.0 110.351 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.431 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 2.1 mt-30 53.21 53.95 12.18 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.237 -0.914 . . . . 0.0 110.285 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 43.5 Cg_endo -70.2 157.13 60.48 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.672 1.354 . . . . 0.0 110.48 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.0 -32.91 10.44 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.653 1.344 . . . . 0.0 110.411 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -120.14 122.75 41.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.229 -0.919 . . . . 0.0 110.281 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 tp -85.69 -36.83 20.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.21 -0.931 . . . . 0.0 110.114 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.459 HG12 ' HD3' ' B' ' 42' ' ' ARG . 45.8 t -51.47 -57.78 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.21 -0.931 . . . . 0.0 109.903 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -62.36 -37.38 85.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.643 -0.661 . . . . 0.0 110.087 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -65.39 -43.17 91.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.274 -0.891 . . . . 0.0 109.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.624 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -57.59 -37.93 74.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.404 -0.81 . . . . 0.0 110.062 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.526 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.2 t -69.71 -50.34 50.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 O-C-N 121.21 -0.931 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.76 -26.09 65.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.505 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.48 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 12.4 t80 -75.82 -68.69 0.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.125 -0.984 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 41' ' ' LEU . 45.3 m-85 -57.81 -47.97 81.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 110.625 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.482 ' OG1' HG13 ' B' ' 35' ' ' VAL . 64.6 m -51.27 -45.52 62.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.12 -0.987 . . . . 0.0 110.023 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -74.0 -26.49 60.47 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.299 -0.875 . . . . 0.0 109.628 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.442 ' HB2' ' HA ' ' A' ' 38' ' ' PHE . 1.3 tp -53.31 -36.55 61.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.932 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -42.15 92.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.319 -0.863 . . . . 0.0 110.113 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.293 -0.879 . . . . 0.0 110.452 -179.886 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.743 HD11 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -86.36 -19.62 29.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -1.136 . . . . 0.0 110.308 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 66.5 m -77.14 -45.66 26.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.239 -0.913 . . . . 0.0 110.269 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -54.98 -57.41 11.79 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.147 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.07 -53.98 42.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.333 -0.855 . . . . 0.0 110.245 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.35 -40.67 74.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -39.76 72.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.116 -0.99 . . . . 0.0 109.922 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.91 -53.47 41.91 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 108.807 -1.717 . . . . 0.0 108.807 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.631 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.5 t80 -48.7 -48.46 40.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.429 -1.042 . . . . 0.0 110.263 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.2 m -54.58 -32.43 58.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.469 -0.769 . . . . 0.0 110.185 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 96.2 t -81.25 -24.85 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 110.54 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.471 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.8 OUTLIER -88.44 -58.47 2.54 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.181 -0.949 . . . . 0.0 109.296 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.759 HG11 HD11 ' A' ' 11' ' ' LEU . 49.8 t -50.67 -40.96 20.11 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.765 -0.584 . . . . 0.0 110.414 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.3 -34.9 59.05 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.175 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.29 -49.35 15.2 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.141 -0.975 . . . . 0.0 110.339 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -76.23 -36.96 58.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.425 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 2.1 mt-30 53.15 53.97 12.29 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.352 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.7 Cg_endo -70.22 157.04 60.75 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.735 1.387 . . . . 0.0 110.503 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.76 -33.1 10.71 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.729 1.384 . . . . 0.0 110.498 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -120.08 123.03 42.39 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.18 -0.95 . . . . 0.0 110.365 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -85.81 -37.12 19.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.074 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.426 HG23 ' H ' ' B' ' 31' ' ' VAL . 46.0 t -51.04 -57.93 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.261 -0.9 . . . . 0.0 110.004 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -62.31 -37.43 85.53 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.527 -0.733 . . . . 0.0 110.17 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.17 -43.45 91.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.854 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.631 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.38 -38.15 73.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.306 -0.871 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.482 HG13 ' OG1' ' A' ' 39' ' ' THR . 99.9 t -69.54 -50.18 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 O-C-N 121.271 -0.893 . . . . 0.0 110.183 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.92 -26.12 65.68 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.298 -0.876 . . . . 0.0 110.512 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.471 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 12.2 t80 -75.91 -68.66 0.55 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.431 ' HA ' ' HB2' ' B' ' 41' ' ' LEU . 45.7 m-85 -57.81 -47.71 81.83 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.909 . . . . 0.0 110.534 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.526 ' OG1' HG13 ' A' ' 35' ' ' VAL . 68.9 m -51.47 -45.64 62.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.022 -1.049 . . . . 0.0 109.963 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -73.74 -26.78 60.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 109.688 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.431 ' HB2' ' HA ' ' B' ' 38' ' ' PHE . 1.3 tp -53.29 -36.55 61.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 109.91 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.459 ' HD3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -59.68 -42.48 93.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 110.036 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.401 -0.812 . . . . 0.0 110.529 -179.884 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -26.08 30.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.224 -1.163 . . . . 0.0 110.303 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -53.47 -56.4 17.27 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.219 -0.926 . . . . 0.0 110.323 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.46 -50.14 63.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.401 -0.812 . . . . 0.0 110.408 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mp -52.83 -53.49 47.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.342 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 15' ' ' LEU . 4.6 mm? -65.37 -51.89 57.39 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 110.434 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.5 -33.05 43.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.062 -1.024 . . . . 0.0 109.897 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.412 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -59.23 -55.85 28.48 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 108.913 -1.675 . . . . 0.0 108.913 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.458 ' CE2' HD11 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -48.2 -44.78 33.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.407 -1.055 . . . . 0.0 110.391 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -55.63 -37.32 68.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.416 -0.802 . . . . 0.0 110.204 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.6 t -80.56 -25.64 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.671 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -85.67 -58.48 2.64 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.001 -1.062 . . . . 0.0 109.083 179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 22' ' ' VAL . 38.9 t -52.03 -34.09 17.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.757 -0.589 . . . . 0.0 110.179 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.5 -33.9 54.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.07 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.54 -66.28 0.91 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.263 -0.898 . . . . 0.0 110.12 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.71 -40.89 66.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.068 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.49 56.61 13.75 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.307 -0.871 . . . . 0.0 110.364 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.51 151.32 58.85 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.66 1.347 . . . . 0.0 110.295 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.78 -28.39 20.43 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.701 1.369 . . . . 0.0 110.26 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.65 120.05 30.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.315 -0.866 . . . . 0.0 110.086 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.458 HD11 ' CE2' ' A' ' 18' ' ' TYR . 9.4 tp -82.88 -36.63 25.2 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 110.287 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 31' ' ' VAL . 44.8 t -51.02 -63.58 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.186 -0.946 . . . . 0.0 110.112 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.48 -35.76 72.69 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.455 -0.778 . . . . 0.0 110.103 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -66.58 -43.18 85.61 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 109.909 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.595 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -59.77 -35.29 74.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.389 -0.819 . . . . 0.0 110.275 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.483 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.4 t -74.24 -45.56 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 121.224 -0.923 . . . . 0.0 110.341 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.47 -20.64 66.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.25 -0.906 . . . . 0.0 110.373 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.51 -71.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.19 -0.944 . . . . 0.0 110.353 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.563 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 42.8 m-85 -56.48 -47.21 79.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.203 -0.936 . . . . 0.0 110.447 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.471 ' OG1' HG13 ' B' ' 35' ' ' VAL . 86.3 m -51.82 -42.85 62.82 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -75.15 -23.45 57.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.194 -0.941 . . . . 0.0 110.03 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -32.73 74.39 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.291 -0.88 . . . . 0.0 110.033 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -29.4 34.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.304 -0.872 . . . . 0.0 110.017 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.418 -0.802 . . . . 0.0 110.1 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -26.01 31.06 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.281 -1.129 . . . . 0.0 110.263 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 38.9 m -53.64 -56.25 18.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.278 -0.889 . . . . 0.0 110.309 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.58 -50.19 63.48 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.361 -0.837 . . . . 0.0 110.365 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.75 -53.57 46.14 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.388 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.449 HD22 ' N ' ' B' ' 15' ' ' LEU . 4.6 mm? -65.27 -51.9 57.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.216 -0.928 . . . . 0.0 110.404 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.58 -33.09 44.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.085 -1.01 . . . . 0.0 109.905 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -59.15 -55.87 28.38 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 108.929 -1.669 . . . . 0.0 108.929 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.46 ' CE2' HD11 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -48.23 -44.57 33.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.37 -1.077 . . . . 0.0 110.416 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.2 m -55.74 -37.41 68.44 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 110.264 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 86.3 t -80.4 -25.8 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.707 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.6 OUTLIER -85.58 -58.34 2.7 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.999 -1.063 . . . . 0.0 109.158 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 18' ' ' TYR . 38.5 t -52.25 -33.98 17.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.775 -0.578 . . . . 0.0 110.27 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.61 -33.77 53.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.166 -0.959 . . . . 0.0 109.976 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.59 -66.17 0.92 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -0.886 . . . . 0.0 110.105 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.79 -41.02 66.8 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 109.973 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.61 56.51 13.5 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.432 -0.793 . . . . 0.0 110.317 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.32 151.31 60.0 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.603 1.317 . . . . 0.0 110.307 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.65 -28.49 20.9 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.744 1.392 . . . . 0.0 110.327 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.6 120.3 31.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.369 -0.832 . . . . 0.0 110.052 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.46 HD11 ' CE2' ' B' ' 18' ' ' TYR . 9.1 tp -83.18 -36.36 24.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.247 -0.908 . . . . 0.0 110.216 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.424 HG23 ' H ' ' B' ' 31' ' ' VAL . 44.6 t -51.17 -63.44 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.246 -0.909 . . . . 0.0 110.052 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.62 -35.76 72.99 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.412 -0.805 . . . . 0.0 110.17 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -66.55 -43.28 85.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.196 -0.94 . . . . 0.0 109.829 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.563 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -59.66 -35.45 74.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 110.258 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.471 HG13 ' OG1' ' A' ' 39' ' ' THR . 91.0 t -74.24 -45.37 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.184 -0.948 . . . . 0.0 110.359 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.6 -20.56 66.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.57 -71.4 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.147 -0.971 . . . . 0.0 110.36 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.595 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 43.1 m-85 -56.32 -47.2 79.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.928 . . . . 0.0 110.435 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.483 ' OG1' HG13 ' A' ' 35' ' ' VAL . 86.8 m -51.78 -42.88 62.75 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.173 -0.954 . . . . 0.0 110.307 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -75.06 -23.64 58.09 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.266 -0.896 . . . . 0.0 110.064 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -32.88 74.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.225 -0.922 . . . . 0.0 110.069 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -29.44 32.91 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.205 -0.934 . . . . 0.0 109.996 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.819 ' O ' HD12 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.469 HD12 ' HG ' ' B' ' 30' ' ' LEU . 3.9 tp -87.82 -41.01 13.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.263 -1.14 . . . . 0.0 110.116 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.2 m -57.86 -57.61 12.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.976 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.08 21.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.404 -0.81 . . . . 0.0 109.984 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.819 HD12 ' O ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER -77.49 -49.58 14.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 109.997 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.39 -53.1 32.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.268 -0.895 . . . . 0.0 109.991 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.491 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -52.15 -43.16 63.92 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.818 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -55.15 -52.11 49.37 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.623 ' HE2' HD11 ' A' ' 30' ' ' LEU . 1.7 t80 -49.14 -49.34 42.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.405 -1.056 . . . . 0.0 110.17 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.0 m -55.7 -36.62 67.38 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.422 -0.799 . . . . 0.0 110.012 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 16' ' ' GLN . 47.6 t -75.04 -25.1 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.249 -0.907 . . . . 0.0 110.601 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.468 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -86.87 -57.99 2.77 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.178 -0.951 . . . . 0.0 109.254 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 18' ' ' TYR . 41.2 t -48.17 -30.99 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.753 -0.592 . . . . 0.0 110.484 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.8 tp -81.89 -37.71 26.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.189 -0.944 . . . . 0.0 110.128 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -77.62 -27.73 51.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.481 -179.87 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 3.5 pm0 -135.48 51.26 2.08 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.11 -0.994 . . . . 0.0 110.615 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -37.75 97.98 0.15 Allowed Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.964 -0.46 . . . . 0.0 111.458 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.6 Cg_endo -74.11 166.31 29.88 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.984 1.518 . . . . 0.0 110.552 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.59 -41.7 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.704 1.371 . . . . 0.0 110.273 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -122.04 116.38 24.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.896 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.623 HD11 ' HE2' ' A' ' 18' ' ' TYR . 0.8 OUTLIER -69.83 -45.1 68.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.225 -0.922 . . . . 0.0 109.686 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -51.79 -59.88 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.902 . . . . 0.0 109.881 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.46 -38.74 78.16 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.582 -0.699 . . . . 0.0 109.994 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -60.31 -46.97 88.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.933 . . . . 0.0 109.685 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.722 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -50.96 -38.44 50.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.425 -0.797 . . . . 0.0 110.389 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.486 HG13 ' OG1' ' B' ' 39' ' ' THR . 46.4 t -71.48 -55.28 14.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.214 -0.929 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.37 -38.34 68.72 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.262 -0.899 . . . . 0.0 110.589 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.468 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 14.6 t80 -68.07 -64.87 0.78 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.55 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.728 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 23.1 m-85 -60.23 -45.58 92.74 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.256 -0.902 . . . . 0.0 110.665 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.494 ' OG1' HG13 ' B' ' 35' ' ' VAL . 96.6 m -56.44 -42.45 78.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.0 110.399 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -73.9 -27.11 60.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.12 -0.987 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.19 -36.71 78.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.254 -0.903 . . . . 0.0 110.269 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.58 -40.28 74.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 110.313 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.175 -0.953 . . . . 0.0 110.221 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 10' ' ' GLY . . . . . 0.84 ' O ' HD12 ' B' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.265 -1.534 . . . . 0.0 109.265 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.532 HD12 ' HG ' ' A' ' 30' ' ' LEU . 3.9 tp -87.84 -40.95 13.58 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.329 -1.101 . . . . 0.0 110.083 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 97.3 m -57.95 -57.54 12.34 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.168 -0.957 . . . . 0.0 109.941 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.15 21.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.365 -0.835 . . . . 0.0 109.911 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.84 HD12 ' O ' ' B' ' 10' ' ' GLY . 1.0 OUTLIER -77.34 -49.86 14.05 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.338 -0.851 . . . . 0.0 109.951 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.31 -52.96 34.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.495 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -52.27 -43.06 64.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.113 -0.992 . . . . 0.0 109.766 179.614 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.419 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -55.33 -51.84 51.64 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 108.826 -1.71 . . . . 0.0 108.826 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.621 ' HE2' HD11 ' B' ' 30' ' ' LEU . 1.7 t80 -49.33 -49.28 44.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.41 -1.053 . . . . 0.0 110.119 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 45.3 m -55.69 -36.71 67.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.452 -0.78 . . . . 0.0 110.049 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 16' ' ' GLN . 47.6 t -75.04 -25.04 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 110.518 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.46 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 1.0 OUTLIER -86.78 -58.2 2.69 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.039 -1.038 . . . . 0.0 109.338 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 18' ' ' TYR . 41.1 t -48.04 -30.89 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.77 -0.582 . . . . 0.0 110.559 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 tp -82.06 -37.6 26.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.97 . . . . 0.0 110.099 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -27.84 50.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.258 -0.901 . . . . 0.0 110.415 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' B' ' 27' ' ' PRO . 3.4 pm0 -135.44 51.45 2.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.135 -0.978 . . . . 0.0 110.52 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' B' ' 22' ' ' VAL . 3.2 mt-30 -37.94 98.05 0.15 Allowed Pre-proline 0 N--CA 1.5 2.035 0 O-C-N 122.009 -0.432 . . . . 0.0 111.464 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 47.8 Cg_endo -74.13 166.25 30.02 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.939 1.494 . . . . 0.0 110.58 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.48 -41.84 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.663 1.349 . . . . 0.0 110.263 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -121.93 116.49 24.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 110.268 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.621 HD11 ' HE2' ' B' ' 18' ' ' TYR . 0.8 OUTLIER -69.99 -45.06 68.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 109.655 179.789 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.0 t -51.72 -59.95 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 109.776 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.41 -38.95 78.43 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.668 -0.645 . . . . 0.0 109.914 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -60.21 -46.86 88.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.927 . . . . 0.0 109.699 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.728 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -50.95 -38.55 51.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.369 -0.832 . . . . 0.0 110.333 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.494 HG13 ' OG1' ' A' ' 39' ' ' THR . 46.4 t -71.39 -55.41 13.89 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.193 -0.942 . . . . 0.0 110.299 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -55.2 -38.4 68.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.46 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 14.6 t80 -68.14 -64.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.888 . . . . 0.0 110.501 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.722 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 23.4 m-85 -60.31 -45.38 93.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.733 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.486 ' OG1' HG13 ' A' ' 35' ' ' VAL . 96.9 m -56.66 -42.23 78.6 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.992 -1.068 . . . . 0.0 110.348 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -74.22 -26.88 60.51 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.29 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.26 -36.58 78.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.0 110.303 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.68 -40.28 75.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.236 -0.915 . . . . 0.0 110.409 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.163 -0.961 . . . . 0.0 110.232 179.933 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -51.16 5.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.174 -1.192 . . . . 0.0 110.27 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 m -52.79 -25.57 11.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.239 -0.913 . . . . 0.0 110.157 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.44 -58.96 3.32 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.165 -0.96 . . . . 0.0 110.239 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.68 -41.47 73.76 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.098 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.29 -44.81 95.05 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.328 -0.857 . . . . 0.0 110.087 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.05 -38.56 65.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.956 . . . . 0.0 109.698 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.53 -58.39 14.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.76 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.7 t80 -46.0 -40.24 10.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.511 -0.993 . . . . 0.0 110.685 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.2 m -62.7 -36.01 81.57 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.388 -0.82 . . . . 0.0 110.01 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 96.8 t -82.18 -21.84 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.26 -0.9 . . . . 0.0 110.745 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.454 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.24 8.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.028 -1.045 . . . . 0.0 109.332 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 18' ' ' TYR . 76.9 t -60.71 -34.5 59.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 121.7 -0.625 . . . . 0.0 110.408 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.36 -41.32 22.18 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.124 -0.985 . . . . 0.0 110.277 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -69.57 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.38 -36.87 64.35 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.253 -0.904 . . . . 0.0 110.173 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.11 59.6 14.47 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.23 -0.919 . . . . 0.0 110.157 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.98 149.8 59.73 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.715 1.376 . . . . 0.0 110.508 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.99 -29.98 17.25 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.723 1.38 . . . . 0.0 110.294 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -125.06 119.64 29.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -78.6 -35.68 45.39 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.246 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -51.05 -68.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.228 -0.92 . . . . 0.0 110.108 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.99 -41.54 71.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.469 -0.77 . . . . 0.0 109.785 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -58.58 -51.81 68.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.534 179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.76 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -53.66 -44.62 69.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.439 -0.788 . . . . 0.0 110.022 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.629 HG13 ' OG1' ' B' ' 39' ' ' THR . 92.9 t -71.04 -29.74 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 O-C-N 121.315 -0.866 . . . . 0.0 110.07 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.23 -26.6 39.02 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.259 -0.901 . . . . 0.0 109.586 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.454 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 27.8 t80 -76.57 -68.12 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.206 -0.933 . . . . 0.0 110.427 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -52.94 -45.81 67.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.304 -0.872 . . . . 0.0 110.65 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.618 ' OG1' HG13 ' B' ' 35' ' ' VAL . 24.0 m -54.51 -40.89 69.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.983 -1.073 . . . . 0.0 109.889 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -28.75 68.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 mt -75.57 -24.65 56.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 110.337 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -47.91 50.11 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.225 -0.922 . . . . 0.0 109.695 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.356 -0.84 . . . . 0.0 110.047 179.871 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.58 -51.06 5.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.134 -1.215 . . . . 0.0 110.293 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 69.3 m -52.98 -25.57 12.48 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.224 -0.922 . . . . 0.0 110.205 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -69.33 -59.09 3.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 110.16 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.51 -41.56 73.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.14 -44.91 94.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.191 -0.943 . . . . 0.0 110.128 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -38.58 65.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -57.74 -58.23 15.66 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.93 -1.668 . . . . 0.0 108.93 179.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.771 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.7 t80 -45.92 -40.33 10.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.534 -0.98 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 80.1 m -62.72 -35.97 81.47 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.104 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 98.8 t -82.27 -21.72 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.749 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.464 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.39 8.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.082 -1.011 . . . . 0.0 109.213 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 18' ' ' TYR . 73.6 t -60.6 -34.55 58.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.762 -0.586 . . . . 0.0 110.452 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.26 -41.34 22.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.122 -0.986 . . . . 0.0 110.251 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -69.62 0.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.302 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.24 -36.75 63.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.304 -0.873 . . . . 0.0 110.269 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 51.94 59.77 14.47 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.267 -0.896 . . . . 0.0 110.174 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.02 149.76 59.43 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.682 1.359 . . . . 0.0 110.529 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -71.04 -29.98 17.06 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.655 1.345 . . . . 0.0 110.327 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -125.03 119.6 29.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.134 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -78.43 -35.9 46.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.191 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.5 t -50.88 -68.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.277 -0.89 . . . . 0.0 110.203 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.94 -41.61 71.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.394 -0.816 . . . . 0.0 109.711 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -58.54 -51.99 67.56 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.294 -0.879 . . . . 0.0 109.511 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.771 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -53.66 -44.5 69.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.363 -0.836 . . . . 0.0 110.027 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.618 HG13 ' OG1' ' A' ' 39' ' ' THR . 90.9 t -71.13 -29.73 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.269 -0.895 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.06 -26.6 39.59 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.241 -0.912 . . . . 0.0 109.546 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.464 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 27.8 t80 -76.67 -68.03 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.17 -0.956 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -53.03 -45.7 68.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.592 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.629 ' OG1' HG13 ' A' ' 35' ' ' VAL . 23.8 m -54.55 -41.11 69.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.022 -1.049 . . . . 0.0 109.753 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -28.83 68.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.188 -0.945 . . . . 0.0 109.974 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.1 mt -75.64 -24.65 56.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 110.341 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -47.78 51.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.169 -0.957 . . . . 0.0 109.684 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.972 179.841 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -38.49 91.02 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -1.158 . . . . 0.0 110.204 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -53.79 -43.18 69.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.347 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.86 -25.34 66.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.924 . . . . 0.0 110.367 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD21 ' HE1' ' A' ' 38' ' ' PHE . 2.6 tp -71.68 -53.07 14.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.4 mt -60.2 -44.49 95.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.08 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -38.21 63.42 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.173 -0.955 . . . . 0.0 109.878 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.29 -57.05 21.16 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.636 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.8 t80 -46.65 -40.57 13.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.524 -0.986 . . . . 0.0 110.575 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.7 m -62.3 -36.57 82.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.394 -0.816 . . . . 0.0 110.267 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.82 -23.37 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.338 -0.851 . . . . 0.0 110.713 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 1.3 mt-10 -87.43 -54.36 4.33 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.01 -1.056 . . . . 0.0 109.246 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.15 -33.79 25.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.281 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 mt -78.35 -36.36 46.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.133 -0.98 . . . . 0.0 110.158 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -55.85 4.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.219 -0.926 . . . . 0.0 110.193 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' A' ' 27' ' ' PRO . 1.0 OUTLIER -61.18 -44.13 97.79 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.294 -0.879 . . . . 0.0 110.203 -179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.63 58.13 14.83 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.296 -0.877 . . . . 0.0 110.312 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' A' ' 25' ' ' GLN . 45.5 Cg_endo -72.35 156.69 54.48 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.589 1.31 . . . . 0.0 110.364 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.45 -19.05 33.33 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.743 1.391 . . . . 0.0 110.509 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.13 119.36 15.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.256 -0.902 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -81.16 -36.25 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.136 -0.977 . . . . 0.0 110.017 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.68 -65.5 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -0.909 . . . . 0.0 109.765 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.24 -41.73 76.19 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.427 -0.795 . . . . 0.0 109.732 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -57.65 -49.23 77.17 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.344 -0.847 . . . . 0.0 109.657 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.657 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -51.93 -34.97 44.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.357 -0.839 . . . . 0.0 110.226 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.29 -53.42 17.23 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.347 -0.846 . . . . 0.0 110.427 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.23 -23.15 46.12 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.0 110.319 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -79.1 -68.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.266 -0.896 . . . . 0.0 110.377 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.655 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 13.1 m-85 -57.08 -45.72 83.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.237 -0.914 . . . . 0.0 110.39 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.403 ' OG1' HG13 ' B' ' 35' ' ' VAL . 83.5 m -53.57 -48.88 68.76 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.937 . . . . 0.0 110.442 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -35.56 80.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.148 -0.97 . . . . 0.0 110.257 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.3 -43.39 67.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.0 110.27 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 -44.44 62.66 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.182 -0.949 . . . . 0.0 110.452 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.99 179.843 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.35 90.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.284 -1.127 . . . . 0.0 110.171 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.0 m -54.03 -43.04 69.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.396 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.82 -25.4 66.42 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.277 -0.889 . . . . 0.0 110.317 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.493 HD21 ' HE1' ' B' ' 38' ' ' PHE . 2.5 tp -71.72 -52.85 15.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.242 -0.911 . . . . 0.0 110.256 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.36 -44.27 95.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.905 . . . . 0.0 110.067 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -38.3 64.26 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.141 -0.974 . . . . 0.0 109.774 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.13 -57.18 20.4 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.642 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.8 t80 -46.6 -40.39 12.82 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.53 -0.982 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -62.6 -36.29 82.26 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.437 -0.789 . . . . 0.0 110.296 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.96 -23.39 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.759 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 1.3 mt-10 -87.58 -54.18 4.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.056 -1.028 . . . . 0.0 109.289 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.18 -33.49 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 O-C-N 121.786 -0.571 . . . . 0.0 110.294 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' B' ' 23' ' ' LEU . 9.3 mt -78.6 -36.46 44.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.135 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.11 -55.83 4.31 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' B' ' 27' ' ' PRO . 1.0 OUTLIER -61.26 -44.01 97.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.6 58.1 14.88 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.319 -0.863 . . . . 0.0 110.383 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' B' ' 25' ' ' GLN . 45.9 Cg_endo -72.42 156.62 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.586 1.309 . . . . 0.0 110.498 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.27 -19.15 34.03 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.709 1.373 . . . . 0.0 110.47 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.16 119.19 15.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.236 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.98 -36.23 31.03 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.022 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.402 HG23 ' H ' ' B' ' 31' ' ' VAL . 41.1 t -53.62 -65.67 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.289 -0.882 . . . . 0.0 109.789 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.06 -41.71 75.48 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.52 -0.737 . . . . 0.0 109.744 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.327 -0.858 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.655 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -52.18 -34.89 47.14 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.348 -0.845 . . . . 0.0 110.194 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.403 HG13 ' OG1' ' A' ' 39' ' ' THR . 61.5 t -74.29 -53.51 16.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.349 -0.844 . . . . 0.0 110.452 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -57.14 -23.24 45.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.428 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -79.06 -68.18 0.68 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.275 -0.891 . . . . 0.0 110.438 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.657 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 13.2 m-85 -57.2 -45.75 83.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.154 -0.966 . . . . 0.0 110.414 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -53.42 -49.22 67.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.255 -0.903 . . . . 0.0 110.436 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.05 -35.78 81.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.155 -0.965 . . . . 0.0 110.298 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.13 -43.42 66.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.5 -44.55 62.56 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.293 -0.879 . . . . 0.0 110.47 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.29 -0.881 . . . . 0.0 109.965 179.828 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 p80 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.206 0.527 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 ttp -118.92 -31.87 4.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.292 -0.88 . . . . 0.0 110.302 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -169.81 -167.08 29.8 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.46 ' C ' HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -103.26 18.71 21.14 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.265 -1.138 . . . . 0.0 110.356 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.46 HD12 ' C ' ' A' ' 4' ' ' HIS . 4.2 mp -134.46 100.1 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.2 -0.937 . . . . 0.0 110.035 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.02 50.27 0.79 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.311 -0.868 . . . . 0.0 110.113 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.498 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.3 tt -58.96 130.6 86.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 O-C-N 121.286 -0.884 . . . . 0.0 110.153 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD2' HG13 ' A' ' 7' ' ' ILE . 46.5 Cg_endo -72.61 137.04 26.93 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.495 1.26 . . . . 0.0 110.398 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.7 178.72 5.98 Favored 'Trans proline' 0 C--N 1.312 -1.366 0 O-C-N 123.535 1.281 . . . . 0.0 110.472 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.0 -32.42 6.4 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.765 HD21 HG11 ' B' ' 22' ' ' VAL . 0.1 OUTLIER -68.67 -57.33 5.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.208 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.6 m -52.4 -28.58 20.36 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.242 -0.911 . . . . 0.0 110.262 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -72.04 -59.19 2.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.625 HD23 ' HE1' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -55.18 -39.44 69.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.923 . . . . 0.0 110.199 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.0 mt -62.91 -43.99 97.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.95 . . . . 0.0 109.957 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.36 -37.95 65.53 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.16 -0.963 . . . . 0.0 109.653 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.44 -55.24 30.69 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.58 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.6 t80 -48.14 -38.83 18.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.404 -1.057 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.85 -36.52 83.53 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.472 -0.768 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.9 -25.07 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.773 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.6 mt-10 -82.69 -57.15 3.45 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.7 HG11 HD21 ' B' ' 11' ' ' LEU . 22.6 t -55.53 -32.91 31.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.126 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.1 -34.53 63.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.261 -0.9 . . . . 0.0 110.233 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.49 -62.59 1.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.204 -0.935 . . . . 0.0 110.362 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.16 -43.12 63.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.216 -0.927 . . . . 0.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.42 62.41 11.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.287 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.23 161.62 45.2 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 O-C-N 123.734 1.386 . . . . 0.0 110.527 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.19 -34.12 10.52 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.638 1.336 . . . . 0.0 110.423 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -129.05 123.85 33.38 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.289 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 tp -77.7 -40.9 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 0.0 110.176 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.427 ' H ' HG23 ' A' ' 31' ' ' VAL . 47.1 t -50.74 -65.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.907 . . . . 0.0 110.019 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.21 -38.95 71.72 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.5 -0.75 . . . . 0.0 110.07 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -62.17 -46.44 88.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.209 -0.932 . . . . 0.0 109.878 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.626 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.33 -33.28 58.58 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 0.0 110.197 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.417 HG13 ' OG1' ' B' ' 39' ' ' THR . 85.7 t -74.96 -49.97 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.333 -0.855 . . . . 0.0 110.248 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.32 -41.03 96.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.236 -0.915 . . . . 0.0 110.332 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.467 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.2 t80 -61.5 -60.12 4.19 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.918 . . . . 0.0 110.3 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.64 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 12.5 m-85 -63.62 -47.78 79.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.431 ' OG1' HG13 ' B' ' 35' ' ' VAL . 54.6 m -52.98 -29.88 31.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.948 . . . . 0.0 109.939 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.13 -34.5 37.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.336 -0.852 . . . . 0.0 109.827 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -23.08 63.76 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.322 -0.861 . . . . 0.0 110.068 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -75.36 -26.4 58.5 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.221 -0.924 . . . . 0.0 109.732 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -105.76 8.14 32.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.31 -0.869 . . . . 0.0 110.484 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -92.98 -65.32 1.01 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.023 -1.048 . . . . 0.0 110.116 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.79 106.39 0.09 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.556 -0.715 . . . . 0.0 110.59 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.7 mtt180 . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.258 -179.838 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 p80 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.204 0.526 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.9 ttp -119.01 -31.52 4.72 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.298 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.03 -167.28 30.28 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' HIS . . . . . 0.462 ' C ' HD12 ' B' ' 5' ' ' ILE . 0.2 OUTLIER -103.19 18.73 21.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.293 -1.122 . . . . 0.0 110.423 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.462 HD12 ' C ' ' B' ' 4' ' ' HIS . 4.2 mp -134.59 100.22 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.181 -0.95 . . . . 0.0 109.975 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.04 50.34 0.79 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.268 -0.895 . . . . 0.0 110.073 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.492 ' O ' HG23 ' B' ' 7' ' ' ILE . 1.3 tt -58.97 130.57 86.47 Favored Pre-proline 0 C--N 1.305 -1.353 0 O-C-N 121.266 -0.896 . . . . 0.0 110.164 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.409 ' HD2' HG13 ' B' ' 7' ' ' ILE . 45.9 Cg_endo -72.6 137.01 26.89 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.461 1.243 . . . . 0.0 110.47 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.71 178.65 6.06 Favored 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.574 1.302 . . . . 0.0 110.431 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.26 -32.81 6.1 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.7 HD21 HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -68.44 -57.45 5.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -1.167 . . . . 0.0 110.235 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.6 m -52.27 -28.6 19.47 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.206 -0.934 . . . . 0.0 110.315 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -71.94 -59.2 2.86 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.184 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.614 HD23 ' HE1' ' B' ' 38' ' ' PHE . 0.2 OUTLIER -55.27 -39.16 69.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.261 -0.9 . . . . 0.0 110.289 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.18 -43.96 96.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.239 -0.913 . . . . 0.0 109.997 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -37.88 65.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.216 -0.928 . . . . 0.0 109.65 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.408 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.31 -55.35 29.96 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.583 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.6 t80 -48.14 -38.82 18.85 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -1.048 . . . . 0.0 110.363 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -36.32 82.93 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.465 -0.772 . . . . 0.0 110.211 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 90.4 t -80.98 -25.24 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.789 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.7 mt-10 -82.53 -57.14 3.47 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.1 -1.0 . . . . 0.0 109.284 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.765 HG11 HD21 ' A' ' 11' ' ' LEU . 22.4 t -55.63 -32.75 31.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 O-C-N 121.708 -0.62 . . . . 0.0 110.101 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.3 -34.38 63.49 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.65 -62.41 1.4 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.25 -0.906 . . . . 0.0 110.346 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.27 -43.22 64.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.311 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.51 62.41 11.12 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.281 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.22 161.51 45.58 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.692 1.364 . . . . 0.0 110.538 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.0 -34.33 10.61 Favored 'Trans proline' 0 C--N 1.31 -1.471 0 O-C-N 123.723 1.38 . . . . 0.0 110.456 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -128.89 124.09 34.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.287 -0.883 . . . . 0.0 110.226 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 tp -77.8 -41.05 38.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 110.082 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.417 HG23 ' H ' ' B' ' 31' ' ' VAL . 46.6 t -50.52 -65.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.245 -0.909 . . . . 0.0 110.046 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.17 -38.99 71.67 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.487 -0.758 . . . . 0.0 110.041 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -62.07 -46.5 88.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.898 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.64 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -54.3 -33.44 58.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.437 -0.79 . . . . 0.0 110.217 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.431 HG13 ' OG1' ' A' ' 39' ' ' THR . 86.7 t -74.87 -49.84 27.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.55 -40.76 95.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.353 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 33.0 t80 -61.65 -60.22 4.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.198 -0.939 . . . . 0.0 110.282 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.626 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 12.5 m-85 -63.48 -47.61 81.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.343 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.417 ' OG1' HG13 ' A' ' 35' ' ' VAL . 52.9 m -53.13 -29.94 34.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.123 -0.986 . . . . 0.0 109.972 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.1 -34.49 37.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 109.87 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.11 -23.09 63.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.337 -0.852 . . . . 0.0 110.084 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -75.43 -26.47 58.37 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.281 -0.887 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -105.71 8.03 32.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.893 . . . . 0.0 110.499 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -92.73 -65.41 1.0 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.03 -1.044 . . . . 0.0 110.123 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.74 106.34 0.09 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.594 -0.691 . . . . 0.0 110.611 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.276 -179.832 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 67.1 m80 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.252 0.548 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ttp -105.61 -42.19 5.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.231 -0.918 . . . . 0.0 110.168 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.47 158.1 0.88 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -134.65 -50.57 0.78 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.316 -1.108 . . . . 0.0 110.193 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -120.06 45.66 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 110.161 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -141.13 38.65 1.76 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.246 -0.909 . . . . 0.0 110.288 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.2 mm -115.26 119.7 37.97 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.188 -0.945 . . . . 0.0 110.131 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.71 113.77 3.84 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 O-C-N 123.548 1.288 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.2 151.3 48.96 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 O-C-N 123.547 1.288 . . . . 0.0 110.332 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.69 -27.06 21.48 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.94 -32.38 72.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -1.172 . . . . 0.0 110.188 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.8 m -69.72 -30.88 68.61 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.158 -0.964 . . . . 0.0 110.228 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -71.48 -54.54 10.26 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.269 -0.894 . . . . 0.0 110.208 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.855 HD21 ' CE1' ' A' ' 38' ' ' PHE . 1.0 OUTLIER -55.59 -53.56 54.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.261 -0.899 . . . . 0.0 110.241 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.852 HD11 HD11 ' B' ' 15' ' ' LEU . 1.2 mm? -53.55 -38.86 64.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.227 -0.921 . . . . 0.0 110.193 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -43.93 70.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.14 -0.975 . . . . 0.0 109.956 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -55.67 -55.69 27.5 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.474 ' CD2' HG21 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -49.24 -47.48 46.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.42 -1.047 . . . . 0.0 110.31 179.552 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 77.7 m -53.15 -36.18 60.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.393 -0.817 . . . . 0.0 110.316 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.26 -25.0 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.174 -0.954 . . . . 0.0 110.417 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.4 mt-10 -89.13 -60.15 2.03 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.21 -0.931 . . . . 0.0 109.2 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.474 HG21 ' CD2' ' A' ' 18' ' ' TYR . 25.4 t -53.59 -26.71 13.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.75 -0.594 . . . . 0.0 110.116 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.409 ' CB ' ' O ' ' A' ' 19' ' ' THR . 2.7 tp -85.08 -35.69 21.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.295 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.27 -56.25 3.34 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.362 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.39 -41.94 81.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.158 -0.964 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 52.04 59.07 15.19 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.245 -0.909 . . . . 0.0 110.161 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.26 156.77 58.53 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.675 1.355 . . . . 0.0 110.573 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.45 -27.48 19.05 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.764 1.402 . . . . 0.0 110.453 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.19 119.93 21.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.41 -32.63 28.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.142 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.504 HG12 ' HD3' ' B' ' 42' ' ' ARG . 39.8 t -53.14 -64.67 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.251 -0.905 . . . . 0.0 109.829 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.91 77.81 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.527 -0.733 . . . . 0.0 109.958 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.55 -48.38 81.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.931 . . . . 0.0 109.521 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.518 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -55.4 -35.06 64.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.873 . . . . 0.0 109.585 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.432 ' CG1' ' OG1' ' B' ' 39' ' ' THR . 55.3 t -81.85 -44.37 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.424 -0.797 . . . . 0.0 109.723 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -26.76 66.96 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.222 -0.924 . . . . 0.0 109.855 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.442 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 38.3 t80 -78.88 -68.02 0.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 110.296 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.855 ' CE1' HD21 ' A' ' 14' ' ' LEU . 17.0 m-85 -52.21 -50.97 60.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.206 -0.934 . . . . 0.0 110.49 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.423 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 90.4 m -50.68 -52.92 35.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.36 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -63.43 -24.07 67.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.483 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.1 tt -65.05 -29.35 70.23 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 109.997 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.44 ' HD3' HG12 ' B' ' 31' ' ' VAL . 0.1 OUTLIER -60.22 -58.14 9.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.332 -0.855 . . . . 0.0 110.174 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -60.63 -23.74 64.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.324 -0.86 . . . . 0.0 110.35 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 41' ' ' LEU . . . -60.74 -71.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.287 -0.883 . . . . 0.0 110.449 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -49.77 -32.83 14.71 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.522 -0.736 . . . . 0.0 110.659 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.227 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 67.4 m80 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.303 0.573 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ttp -105.52 -42.28 5.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.315 -0.866 . . . . 0.0 110.196 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.55 158.16 0.91 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -134.75 -50.72 0.78 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -1.16 . . . . 0.0 110.137 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.95 45.56 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.402 -0.811 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -140.9 38.59 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 110.352 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 36.1 mm -115.35 119.75 37.71 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.259 -0.901 . . . . 0.0 110.085 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.7 113.69 3.81 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.523 1.275 . . . . 0.0 110.5 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.03 151.39 49.95 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.591 1.311 . . . . 0.0 110.361 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -26.96 21.72 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.5 tp -67.94 -32.46 72.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -1.149 . . . . 0.0 110.144 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 86.0 m -69.8 -30.68 68.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.304 -0.872 . . . . 0.0 110.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -71.61 -54.4 10.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.848 HD21 ' CE1' ' B' ' 38' ' ' PHE . 1.0 OUTLIER -55.77 -53.51 55.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.852 HD11 HD11 ' A' ' 15' ' ' LEU . 1.2 mm? -53.5 -38.96 64.2 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.32 -0.863 . . . . 0.0 110.208 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -44.17 70.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.283 -0.886 . . . . 0.0 109.946 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.41 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -55.37 -55.96 25.83 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.488 ' CD2' HG21 ' B' ' 22' ' ' VAL . 0.9 OUTLIER -49.0 -47.49 44.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.373 -1.075 . . . . 0.0 110.401 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.412 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 76.1 m -53.22 -36.14 60.7 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.423 -0.798 . . . . 0.0 110.323 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -78.19 -25.2 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.246 -0.909 . . . . 0.0 110.4 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.455 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.4 mt-10 -88.91 -60.14 2.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.236 -0.915 . . . . 0.0 109.257 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.488 HG21 ' CD2' ' B' ' 18' ' ' TYR . 25.0 t -53.51 -26.78 13.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.676 -0.64 . . . . 0.0 110.149 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.412 ' CB ' ' O ' ' B' ' 19' ' ' THR . 2.7 tp -85.05 -35.73 21.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 -56.32 3.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.893 . . . . 0.0 110.335 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.26 -41.88 80.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.135 -0.978 . . . . 0.0 110.49 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 51.92 59.17 15.22 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.192 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 156.89 57.87 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 O-C-N 123.755 1.397 . . . . 0.0 110.535 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.54 -27.48 18.75 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.676 1.356 . . . . 0.0 110.411 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.2 119.9 21.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.37 -32.84 29.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.886 . . . . 0.0 110.16 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.44 HG12 ' HD3' ' A' ' 42' ' ' ARG . 39.8 t -52.9 -64.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.264 -0.897 . . . . 0.0 109.865 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.94 77.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.558 -0.714 . . . . 0.0 109.976 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -61.44 -48.52 80.8 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.19 -0.944 . . . . 0.0 109.54 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.508 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -55.32 -35.28 64.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.375 -0.828 . . . . 0.0 109.573 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.423 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 57.1 t -81.66 -44.17 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 O-C-N 121.477 -0.764 . . . . 0.0 109.783 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.27 -26.65 66.67 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.455 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 38.4 t80 -78.98 -67.9 0.71 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.146 -0.971 . . . . 0.0 110.283 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.848 ' CE1' HD21 ' B' ' 14' ' ' LEU . 16.9 m-85 -52.22 -51.01 60.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.239 -0.913 . . . . 0.0 110.426 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.432 ' OG1' ' CG1' ' A' ' 35' ' ' VAL . 84.8 m -50.69 -52.94 35.31 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.38 -24.2 67.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.342 -0.849 . . . . 0.0 109.955 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.488 ' O ' ' HB3' ' B' ' 44' ' ' ALA . 1.1 tt -64.91 -29.33 70.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.504 ' HD3' HG12 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -60.22 -58.25 9.3 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.328 -0.857 . . . . 0.0 110.127 179.874 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -60.52 -23.64 64.72 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' B' ' 41' ' ' LEU . . . -61.0 -71.81 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.471 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -49.64 -32.89 14.03 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.54 -0.725 . . . . 0.0 110.727 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.6 m80 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.42 76.81 0.69 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.27 -139.96 14.92 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.0 169.97 18.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.187 -1.184 . . . . 0.0 110.219 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.423 ' N ' HD12 ' A' ' 5' ' ' ILE . 4.3 mp -113.92 148.84 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.263 -0.898 . . . . 0.0 110.073 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -131.07 143.52 50.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.251 -0.906 . . . . 0.0 110.117 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.453 HD12 ' C ' ' A' ' 7' ' ' ILE . 1.3 pp -146.83 58.32 4.25 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.279 -0.888 . . . . 0.0 110.442 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.36 145.76 54.56 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.75 1.395 . . . . 0.0 110.706 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -74.32 -171.69 0.98 Allowed 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.705 1.371 . . . . 0.0 110.425 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.32 -43.84 2.8 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.3 tp -77.5 -38.57 48.67 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -1.152 . . . . 0.0 110.37 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.7 m -63.46 -37.93 89.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.205 -0.935 . . . . 0.0 110.383 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.04 -41.76 68.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 110.282 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.56 -44.13 71.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.225 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.687 HD21 ' HD2' ' B' ' 18' ' ' TYR . 91.8 mt -67.83 -51.58 46.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 0.0 110.173 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.42 -34.61 25.11 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.068 -1.02 . . . . 0.0 109.932 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.44 -58.74 12.81 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.673 ' HD2' HD21 ' B' ' 15' ' ' LEU . 1.3 t80 -47.54 -44.56 26.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.447 -1.031 . . . . 0.0 110.663 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 m -50.74 -55.72 15.36 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.048 -1.033 . . . . 0.0 108.906 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.79 -44.27 98.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -52.55 -69.05 0.12 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.426 0.632 . . . . 0.0 110.768 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -52.44 -22.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.389 -0.819 . . . . 0.0 110.519 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.88 -20.99 34.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 110.195 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.77 -56.53 2.26 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.215 -0.928 . . . . 0.0 110.163 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -57.09 -43.58 82.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.26 -0.9 . . . . 0.0 110.148 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.454 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 0.0 OUTLIER 52.57 52.79 11.43 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.372 -0.83 . . . . 0.0 110.162 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 45.1 Cg_endo -71.28 156.18 59.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.633 1.333 . . . . 0.0 110.395 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.33 -29.84 16.4 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.658 1.346 . . . . 0.0 110.167 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.64 119.59 29.45 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.46 -41.93 23.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 0.0 110.346 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.558 HG12 ' HG2' ' B' ' 42' ' ' ARG . 41.2 t -50.7 -59.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.234 -0.916 . . . . 0.0 110.047 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -62.01 -36.02 80.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.508 -0.745 . . . . 0.0 110.024 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.419 ' HD2' ' HH ' ' A' ' 18' ' ' TYR . 53.3 t80 -65.49 -44.11 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.287 -0.883 . . . . 0.0 109.706 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.425 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.12 -36.07 70.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.443 -0.786 . . . . 0.0 110.124 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.541 HG13 ' OG1' ' B' ' 39' ' ' THR . 98.1 t -78.06 -44.91 27.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.56 -30.29 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.386 -0.821 . . . . 0.0 110.55 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -76.71 -58.26 3.38 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.157 -0.964 . . . . 0.0 110.376 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.404 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 12.6 m-85 -65.57 -43.17 90.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.546 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.488 ' OG1' HG13 ' B' ' 35' ' ' VAL . 53.7 m -54.68 -44.83 73.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.081 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.91 -31.92 72.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.172 -0.955 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -28.19 68.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 109.975 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.425 ' HG2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -68.6 -30.32 69.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.03 -33.89 75.45 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.293 -0.88 . . . . 0.0 110.072 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.94 -64.42 0.82 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.829 . . . . 0.0 110.234 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -48.96 160.58 0.18 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.597 -0.689 . . . . 0.0 110.558 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.255 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 5.6 m80 . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.23 0.538 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.45 76.72 0.69 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.295 -0.878 . . . . 0.0 110.142 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.25 -139.85 14.87 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.02 169.88 18.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.185 -1.185 . . . . 0.0 110.319 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.425 HD12 ' N ' ' B' ' 5' ' ' ILE . 4.3 mp -113.86 148.76 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.33 -0.856 . . . . 0.0 110.038 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -131.1 143.43 50.65 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.45 ' C ' HD12 ' B' ' 7' ' ' ILE . 1.3 pp -146.84 58.54 4.41 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.271 -0.893 . . . . 0.0 110.364 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.49 145.85 54.03 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.64 1.337 . . . . 0.0 110.637 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.34 -171.57 0.95 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.669 1.352 . . . . 0.0 110.515 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.29 -44.03 2.8 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -77.48 -38.46 49.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.201 -1.176 . . . . 0.0 110.386 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 57.0 m -63.48 -38.1 89.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.11 -0.994 . . . . 0.0 110.331 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.84 -41.79 67.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.257 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.65 -43.99 71.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 110.29 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.673 HD21 ' HD2' ' A' ' 18' ' ' TYR . 92.1 mt -67.87 -51.36 49.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.68 -34.46 26.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.157 -0.964 . . . . 0.0 110.005 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' B' ' 21' ' ' GLU . . . -59.64 -58.5 13.95 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.687 ' HD2' HD21 ' A' ' 15' ' ' LEU . 1.3 t80 -47.76 -44.55 28.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -1.016 . . . . 0.0 110.602 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -50.6 -55.7 15.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.047 -1.033 . . . . 0.0 108.878 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.5 t -63.82 -44.38 98.15 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.0 OUTLIER -52.49 -69.01 0.12 Allowed 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.374 0.607 . . . . 0.0 110.734 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.8 t -52.52 -22.73 3.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 O-C-N 121.38 -0.825 . . . . 0.0 110.498 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.8 -21.47 34.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.109 -0.995 . . . . 0.0 110.059 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.28 -56.43 2.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.283 -0.886 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -57.27 -43.68 83.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.158 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.0 OUTLIER 52.84 52.6 10.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.378 -0.826 . . . . 0.0 110.163 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 44.3 Cg_endo -71.05 156.14 60.43 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.639 1.337 . . . . 0.0 110.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.38 -29.63 16.56 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.667 1.351 . . . . 0.0 110.094 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.76 119.43 28.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.365 -0.834 . . . . 0.0 110.109 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.5 -42.03 23.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.239 -0.913 . . . . 0.0 110.254 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.425 HG12 ' HG2' ' A' ' 42' ' ' ARG . 41.1 t -50.66 -59.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.931 . . . . 0.0 110.051 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -62.05 -35.98 80.25 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.59 -0.694 . . . . 0.0 109.971 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 53.2 t80 -65.52 -43.85 88.76 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.309 -0.87 . . . . 0.0 109.656 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.417 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.59 -36.07 71.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.372 -0.83 . . . . 0.0 110.097 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.488 HG13 ' OG1' ' A' ' 39' ' ' THR . 92.4 t -78.02 -44.68 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 O-C-N 121.202 -0.936 . . . . 0.0 110.154 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.69 -30.64 68.92 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.331 -0.856 . . . . 0.0 110.573 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.407 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 74.0 t80 -76.35 -58.32 3.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.129 -0.982 . . . . 0.0 110.367 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -65.58 -42.52 91.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.597 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.541 ' OG1' HG13 ' A' ' 35' ' ' VAL . 53.5 m -55.24 -44.72 75.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.003 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.96 -32.11 72.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.02 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -28.39 68.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.277 -0.89 . . . . 0.0 109.968 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.558 ' HG2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -68.63 -30.09 68.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.286 -0.884 . . . . 0.0 110.195 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.29 -33.83 75.05 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.918 . . . . 0.0 110.086 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -53.03 -64.14 0.92 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.897 . . . . 0.0 110.273 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.1 160.66 0.19 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.492 -0.755 . . . . 0.0 110.514 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.183 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.247 0.546 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttt -152.4 34.23 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.32 -0.862 . . . . 0.0 110.146 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.81 64.21 0.32 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -151.14 157.2 42.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.561 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.2 tp -100.26 60.1 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.277 -0.889 . . . . 0.0 110.153 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.411 ' C ' HD12 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -107.89 -171.48 1.88 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.266 -0.896 . . . . 0.0 110.234 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.607 ' N ' HD12 ' A' ' 7' ' ' ILE . 1.8 mp -93.51 138.35 23.0 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 109.536 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.02 151.08 55.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.689 1.363 . . . . 0.0 110.715 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.11 173.96 12.1 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.785 1.413 . . . . 0.0 110.345 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.46 -41.07 2.53 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -73.76 -28.44 61.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.314 -1.109 . . . . 0.0 110.184 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.5 m -71.64 -43.67 65.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.079 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.9 -36.66 62.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -0.875 . . . . 0.0 110.435 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.83 -50.39 35.98 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.895 . . . . 0.0 110.404 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.68 -49.14 72.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.19 -0.944 . . . . 0.0 110.136 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.97 -34.71 60.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.145 -0.972 . . . . 0.0 109.772 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.96 -52.8 46.6 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 108.705 -1.758 . . . . 0.0 108.705 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.588 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -47.67 -37.9 13.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.492 -1.005 . . . . 0.0 110.149 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -65.77 -33.05 74.96 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.585 -0.697 . . . . 0.0 110.335 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.8 t -81.3 -27.28 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 110.687 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -80.79 -56.9 3.82 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.055 -1.028 . . . . 0.0 109.378 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 30' ' ' LEU . 25.8 t -56.7 -31.91 36.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.763 -0.585 . . . . 0.0 110.294 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -75.15 -30.76 60.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.236 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.03 -51.71 4.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.205 -0.934 . . . . 0.0 110.484 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.6 -34.49 67.43 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.224 -0.922 . . . . 0.0 109.961 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.97 71.3 1.53 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.267 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.83 169.74 20.48 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.652 1.343 . . . . 0.0 110.462 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.12 -37.98 7.59 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.734 1.386 . . . . 0.0 110.331 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 33' ' ' PHE . 2.6 t70 -145.37 148.14 33.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.264 -0.898 . . . . 0.0 110.087 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.574 HD21 HG11 ' A' ' 22' ' ' VAL . 1.2 mt -83.71 -41.05 18.12 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.244 -0.91 . . . . 0.0 110.176 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.427 ' O ' HG23 ' A' ' 35' ' ' VAL . 41.2 t -52.13 -63.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.216 -0.928 . . . . 0.0 109.848 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.62 -39.66 85.0 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.539 -0.725 . . . . 0.0 109.882 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.423 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 34.1 t80 -62.83 -51.36 67.35 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 109.783 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.588 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -55.28 -33.88 63.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.387 -0.821 . . . . 0.0 110.004 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.499 HG13 ' OG1' ' B' ' 39' ' ' THR . 68.9 t -75.4 -50.51 23.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.32 -0.862 . . . . 0.0 110.198 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.46 -28.8 70.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.211 -0.93 . . . . 0.0 110.485 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -77.76 -63.08 1.47 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.219 -0.925 . . . . 0.0 110.471 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -58.6 -43.66 89.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.23 -0.919 . . . . 0.0 110.506 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.489 ' OG1' HG13 ' B' ' 35' ' ' VAL . 65.3 m -57.76 -46.24 84.79 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.335 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.04 -21.62 61.51 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.389 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.489 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -77.29 -20.3 55.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.381 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -23.0 43.74 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.227 -0.92 . . . . 0.0 109.758 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.6 -19.47 52.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.098 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.44 -57.43 2.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 110.398 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -47.89 -28.13 2.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.604 -0.685 . . . . 0.0 110.888 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.19 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.233 0.54 . . . . 0.0 110.14 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttt -152.33 34.13 0.51 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.273 -0.892 . . . . 0.0 110.175 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.68 64.23 0.33 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -151.27 157.2 42.25 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -1.164 . . . . 0.0 110.175 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.54 ' O ' HG23 ' B' ' 5' ' ' ILE . 1.2 tp -100.22 59.97 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.314 -0.866 . . . . 0.0 110.254 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' GLN . . . . . 0.424 ' C ' HD12 ' B' ' 7' ' ' ILE . 0.0 OUTLIER -107.71 -171.21 1.83 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.208 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.626 HD12 ' N ' ' B' ' 7' ' ' ILE . 1.8 mp -93.81 138.35 22.81 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.195 -0.941 . . . . 0.0 109.495 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.92 151.09 56.2 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.64 1.337 . . . . 0.0 110.651 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.12 174.05 11.97 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.7 1.369 . . . . 0.0 110.397 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.32 -40.72 2.61 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -74.14 -28.39 61.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -1.135 . . . . 0.0 110.136 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.7 m -71.67 -43.69 65.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 110.125 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.83 -36.56 62.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.252 -0.905 . . . . 0.0 110.456 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tp -70.83 -50.44 35.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.175 -0.953 . . . . 0.0 110.336 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.71 -49.14 72.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.95 -34.94 61.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.066 -1.022 . . . . 0.0 109.633 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.67 -53.01 44.5 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.582 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.4 t80 -47.61 -37.96 13.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.459 -1.024 . . . . 0.0 110.097 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.3 m -65.75 -32.93 74.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.584 -0.698 . . . . 0.0 110.401 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 55.8 t -81.3 -27.46 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 110.739 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.57 -57.16 3.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.216 -0.927 . . . . 0.0 109.43 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.554 HG11 HD21 ' B' ' 30' ' ' LEU . 26.1 t -56.45 -31.84 34.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.76 -0.588 . . . . 0.0 110.305 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 47.7 tp -75.31 -30.57 60.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.221 -0.924 . . . . 0.0 110.334 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.18 -51.65 4.33 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 0.0 110.486 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.71 -34.64 67.25 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.27 -0.894 . . . . 0.0 109.797 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.21 71.15 1.56 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.283 -0.885 . . . . 0.0 110.304 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.79 169.82 20.23 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.591 1.311 . . . . 0.0 110.466 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.18 -37.78 7.71 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.691 1.364 . . . . 0.0 110.315 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -145.61 148.05 32.7 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 110.084 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.554 HD21 HG11 ' B' ' 22' ' ' VAL . 1.1 mt -83.59 -41.28 18.03 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.415 ' O ' HG23 ' B' ' 35' ' ' VAL . 41.0 t -51.88 -63.36 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.916 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.68 -39.63 85.15 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.531 -0.731 . . . . 0.0 109.893 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.424 ' CD2' ' CE1' ' B' ' 18' ' ' TYR . 34.2 t80 -62.84 -51.11 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.795 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.582 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -55.53 -33.89 64.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 109.959 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.489 HG13 ' OG1' ' A' ' 39' ' ' THR . 70.3 t -75.41 -50.42 24.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.252 -0.905 . . . . 0.0 110.124 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.6 -28.78 70.13 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.253 -0.904 . . . . 0.0 110.445 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -77.57 -63.37 1.39 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.224 -0.922 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -58.38 -43.83 88.63 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.503 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.499 ' OG1' HG13 ' A' ' 35' ' ' VAL . 64.5 m -57.55 -46.2 84.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 0.0 110.359 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.14 -21.54 61.44 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.201 -0.937 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.498 ' O ' HD23 ' B' ' 41' ' ' LEU . 0.9 OUTLIER -77.52 -20.11 54.75 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.348 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.48 -22.78 43.62 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.225 -0.922 . . . . 0.0 109.763 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.69 -19.54 52.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.262 -0.899 . . . . 0.0 110.17 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.37 -57.33 2.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.19 -0.944 . . . . 0.0 110.396 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -48.11 -27.9 2.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.534 -0.729 . . . . 0.0 110.869 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.087 -0.958 . . . . 0.0 110.197 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.9 t60 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.288 0.566 . . . . 0.0 110.08 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -43.89 0.75 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.344 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 153.02 170.75 19.65 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -148.42 85.23 1.51 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -1.131 . . . . 0.0 110.236 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 5' ' ' ILE . 0.9 OUTLIER -112.46 62.36 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -109.23 41.14 1.69 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 110.243 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.8 mm -129.54 84.57 61.29 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 0.0 110.084 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -72.05 114.32 3.94 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.781 1.411 . . . . 0.0 110.456 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.66 162.79 40.32 Favored 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 123.598 1.315 . . . . 0.0 110.453 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.47 -29.52 9.53 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.476 HD11 HG11 ' B' ' 22' ' ' VAL . 1.0 OUTLIER -63.78 -38.73 92.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.235 -1.156 . . . . 0.0 110.146 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 48.4 m -57.75 -56.38 22.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.55 -50.38 53.57 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.439 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.443 ' HA ' HD12 ' A' ' 14' ' ' LEU . 7.8 tp -54.54 -55.52 28.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.46 -51.78 67.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.92 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.64 -30.41 31.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.003 -1.06 . . . . 0.0 109.648 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -58.47 -56.81 23.2 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 179.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.437 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t80 -47.65 -38.17 14.33 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.485 -1.009 . . . . 0.0 110.338 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 1.1 m -64.63 -34.18 77.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.43 -0.793 . . . . 0.0 109.844 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.34 -27.09 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.364 -0.835 . . . . 0.0 110.358 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -82.84 -59.25 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.089 -1.007 . . . . 0.0 108.99 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.49 HG11 ' CD2' ' A' ' 30' ' ' LEU . 43.5 t -55.03 -32.01 26.37 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.827 -0.546 . . . . 0.0 110.522 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 19' ' ' THR . 0.9 OUTLIER -83.73 -22.47 31.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.81 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.74 -58.58 2.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.456 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.44 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -82.92 -22.22 33.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.19 -0.944 . . . . 0.0 110.571 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.8 77.42 0.44 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.106 -0.996 . . . . 0.0 110.004 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 22' ' ' VAL . 44.4 Cg_endo -70.52 153.78 65.18 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.672 1.354 . . . . 0.0 110.574 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.82 -28.14 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.701 1.369 . . . . 0.0 110.441 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.96 125.28 12.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.347 -0.845 . . . . 0.0 110.15 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.49 ' CD2' HG11 ' A' ' 22' ' ' VAL . 1.2 mp -76.82 -31.38 56.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.292 -0.88 . . . . 0.0 109.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.866 HG12 ' HG2' ' B' ' 42' ' ' ARG . 44.8 t -54.3 -61.17 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 109.859 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.24 -45.69 83.61 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.964 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 25' ' ' GLN . 49.4 t80 -58.15 -47.4 83.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 109.87 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.52 -34.98 52.25 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.373 -0.83 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' B' ' 39' ' ' THR . 94.0 t -80.85 -52.46 14.17 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 121.19 -0.944 . . . . 0.0 110.14 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.85 -40.31 66.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.314 -0.866 . . . . 0.0 110.554 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -70.38 -68.22 0.44 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.979 . . . . 0.0 110.347 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.4 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 6.3 m-85 -50.47 -42.42 54.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.549 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.457 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.4 m -58.7 -35.72 73.09 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.103 -0.998 . . . . 0.0 109.855 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.44 -42.22 87.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.292 -0.88 . . . . 0.0 109.952 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.424 ' HA ' HD23 ' A' ' 41' ' ' LEU . 20.1 mt -59.21 -35.55 73.81 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.287 -0.883 . . . . 0.0 109.982 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.708 ' HG2' HG12 ' B' ' 31' ' ' VAL . 3.7 mmm-85 -56.13 -38.42 70.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.43 -0.794 . . . . 0.0 110.066 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -15.09 61.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.313 -0.867 . . . . 0.0 110.546 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -90.09 -63.21 1.31 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.057 -1.027 . . . . 0.0 110.497 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -47.79 136.42 10.82 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.517 -0.74 . . . . 0.0 110.886 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.189 -179.876 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 33.0 t60 . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.237 0.541 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.88 -43.98 0.73 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.281 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 153.06 170.87 19.81 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 67.8 m-70 -148.43 85.34 1.51 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.601 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.9 OUTLIER -112.56 62.25 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.137 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 6' ' ' GLN . . . . . 0.401 ' O ' HD13 ' B' ' 7' ' ' ILE . 20.4 mt-30 -109.17 41.12 1.69 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 110.259 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.401 HD13 ' O ' ' B' ' 6' ' ' GLN . 46.6 mm -129.42 84.46 61.96 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 110.105 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.86 114.41 3.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.666 1.35 . . . . 0.0 110.535 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.78 162.64 40.63 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.534 1.281 . . . . 0.0 110.43 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.68 -29.58 9.58 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.44 HD11 HG11 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -63.84 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -1.134 . . . . 0.0 110.151 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 47.5 m -57.67 -56.7 18.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.299 -0.876 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.3 -50.56 50.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.336 -0.852 . . . . 0.0 110.418 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.44 ' HA ' HD12 ' B' ' 14' ' ' LEU . 7.8 tp -54.59 -55.35 30.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.878 . . . . 0.0 110.311 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.54 -51.81 67.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.269 -0.894 . . . . 0.0 110.264 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.61 -30.57 32.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.112 -0.992 . . . . 0.0 109.654 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -58.27 -56.77 23.4 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 108.806 -1.717 . . . . 0.0 108.806 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.437 ' O ' HG23 ' B' ' 22' ' ' VAL . 1.1 t80 -47.81 -38.04 14.97 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.365 -1.079 . . . . 0.0 110.322 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' B' ' 23' ' ' LEU . 1.0 OUTLIER -64.77 -33.88 77.03 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.389 -0.819 . . . . 0.0 109.838 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.63 -26.91 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.34 -0.85 . . . . 0.0 110.415 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.7 OUTLIER -83.0 -59.37 2.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.948 . . . . 0.0 108.897 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.49 HG11 ' CD2' ' B' ' 30' ' ' LEU . 43.8 t -54.91 -32.16 26.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.83 -0.543 . . . . 0.0 110.528 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' B' ' 19' ' ' THR . 0.9 OUTLIER -83.51 -22.58 32.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.089 -1.007 . . . . 0.0 110.363 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.61 -58.6 2.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.391 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.431 ' OE1' ' CZ ' ' B' ' 33' ' ' PHE . 0.0 OUTLIER -82.98 -22.29 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.59 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.89 77.44 0.44 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.117 -0.99 . . . . 0.0 109.971 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 22' ' ' VAL . 44.2 Cg_endo -70.66 153.83 64.54 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.717 1.377 . . . . 0.0 110.534 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.85 -28.16 20.34 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 O-C-N 123.838 1.441 . . . . 0.0 110.443 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.98 125.14 12.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.169 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.49 ' CD2' HG11 ' B' ' 22' ' ' VAL . 1.2 mp -76.68 -31.39 57.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.878 . . . . 0.0 110.025 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.708 HG12 ' HG2' ' A' ' 42' ' ' ARG . 43.9 t -54.22 -61.3 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.303 -0.873 . . . . 0.0 109.789 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -65.21 -45.45 84.66 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.431 ' CZ ' ' OE1' ' B' ' 25' ' ' GLN . 49.4 t80 -58.41 -47.41 84.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.849 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.38 -35.05 50.57 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.361 -0.837 . . . . 0.0 110.23 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.457 HG13 ' OG1' ' A' ' 39' ' ' THR . 94.8 t -80.79 -52.64 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.64 -40.41 65.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -70.23 -68.41 0.42 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.071 -1.018 . . . . 0.0 110.294 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -50.47 -42.31 54.21 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' A' ' 35' ' ' VAL . 54.9 m -58.61 -35.86 73.12 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.143 -0.973 . . . . 0.0 109.907 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -42.26 88.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 109.945 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' B' ' 41' ' ' LEU . 20.2 mt -59.26 -35.45 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.302 -0.874 . . . . 0.0 109.953 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.866 ' HG2' HG12 ' A' ' 31' ' ' VAL . 3.7 mmm-85 -56.14 -38.5 70.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.321 -0.862 . . . . 0.0 110.134 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.77 -15.18 61.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.484 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -89.95 -63.3 1.3 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.086 -1.009 . . . . 0.0 110.512 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -47.67 136.57 10.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.575 -0.703 . . . . 0.0 110.802 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.315 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.7 m80 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.287 0.565 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 mtt -99.0 108.17 20.78 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.257 -0.902 . . . . 0.0 110.134 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.4 -164.04 29.87 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -147.55 140.26 24.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.256 -1.143 . . . . 0.0 110.182 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 47.3 mm -101.75 154.49 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 177.98 6.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.201 -0.937 . . . . 0.0 110.302 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.5 mm -74.84 136.19 73.86 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.299 -0.876 . . . . 0.0 109.835 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.42 137.95 31.76 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.527 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.43 167.45 26.96 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.61 1.321 . . . . 0.0 110.388 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.35 -38.82 2.98 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -75.09 -19.34 60.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -1.168 . . . . 0.0 110.325 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.7 m -69.96 -54.85 11.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.216 -0.928 . . . . 0.0 110.341 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -54.22 -37.12 64.23 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.327 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 14' ' ' LEU . 16.5 mt -63.06 -59.35 4.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.197 -0.939 . . . . 0.0 110.289 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.31 -48.81 80.22 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.353 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.32 -38.64 63.38 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.188 -0.945 . . . . 0.0 109.92 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.83 -52.8 48.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.33 -47.74 36.7 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.388 -1.066 . . . . 0.0 110.094 179.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.8 -40.93 56.65 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.387 -0.821 . . . . 0.0 110.471 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -76.97 -25.29 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.219 -0.926 . . . . 0.0 110.822 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -86.3 -59.08 2.39 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.07 -1.019 . . . . 0.0 109.241 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.41 ' H ' HG23 ' A' ' 22' ' ' VAL . 44.1 t -52.31 -26.71 9.45 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.3 tp -85.41 -38.13 19.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.093 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -53.52 5.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.205 -0.935 . . . . 0.0 110.082 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -61.64 -41.38 97.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 110.104 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 50.03 56.24 17.45 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.337 -0.852 . . . . 0.0 110.375 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.39 155.81 59.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.623 1.328 . . . . 0.0 110.419 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.5 -21.53 25.88 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 O-C-N 123.706 1.372 . . . . 0.0 110.524 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.67 119.48 15.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.281 -0.887 . . . . 0.0 110.321 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.96 -30.23 35.21 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.337 -0.852 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.2 t -51.51 -66.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.187 -0.946 . . . . 0.0 110.063 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.404 ' OD1' ' NH1' ' B' ' 42' ' ' ARG . 1.1 t70 -55.39 -42.76 74.45 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.363 -0.835 . . . . 0.0 109.971 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -58.31 -50.25 74.3 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.826 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.55 64.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.352 -0.843 . . . . 0.0 110.366 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.552 HG13 ' OG1' ' B' ' 39' ' ' THR . 91.6 t -74.04 -46.12 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.179 -0.951 . . . . 0.0 110.26 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.44 -24.22 67.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -73.36 -68.13 0.52 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.233 -0.917 . . . . 0.0 110.391 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.427 ' HB3' HG23 ' B' ' 35' ' ' VAL . 29.9 m-85 -59.33 -50.78 72.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.944 . . . . 0.0 110.389 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.56 ' OG1' HG13 ' B' ' 35' ' ' VAL . 97.8 m -49.97 -33.77 18.81 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.12 -0.988 . . . . 0.0 110.235 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -75.39 -25.28 57.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -38.28 90.2 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' NH1' ' OD1' ' B' ' 32' ' ' ASP . 0.0 OUTLIER -50.54 -40.01 50.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 179.707 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -76.48 -25.29 54.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 110.121 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.12 -67.37 0.58 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.245 -0.909 . . . . 0.0 110.19 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -50.88 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.556 -0.715 . . . . 0.0 110.526 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 mtp180 . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.177 179.756 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 2.8 m80 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.248 0.547 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.7 mtt -98.8 107.94 20.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.855 . . . . 0.0 110.178 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.06 -164.31 29.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -147.46 140.18 24.83 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.299 -1.118 . . . . 0.0 110.163 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 47.2 mm -101.74 154.49 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.253 -0.904 . . . . 0.0 110.143 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.83 178.04 6.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.189 -0.944 . . . . 0.0 110.285 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -74.83 136.28 73.86 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.229 -0.919 . . . . 0.0 109.888 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.5 137.88 31.38 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.532 1.28 . . . . 0.0 110.417 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.43 167.52 26.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.632 1.333 . . . . 0.0 110.51 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.29 -38.84 2.96 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -74.97 -19.69 59.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -1.144 . . . . 0.0 110.301 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 74.9 m -69.56 -54.87 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 110.37 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.29 -37.07 64.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.332 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 14' ' ' LEU . 16.6 mt -63.01 -59.57 4.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.291 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.2 -48.66 80.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 110.283 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -53.36 -38.88 63.71 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.019 -1.05 . . . . 0.0 109.916 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.42 -53.15 45.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 108.86 -1.696 . . . . 0.0 108.86 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.12 -47.68 34.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.405 -1.056 . . . . 0.0 110.146 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.9 -40.82 57.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.518 -0.739 . . . . 0.0 110.513 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -77.14 -25.2 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.185 -0.947 . . . . 0.0 110.676 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.6 OUTLIER -86.42 -58.86 2.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.105 -0.997 . . . . 0.0 109.265 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 44.4 t -52.51 -26.64 10.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 121.729 -0.607 . . . . 0.0 110.214 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -85.47 -38.17 18.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.26 -0.9 . . . . 0.0 110.056 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.82 -53.53 5.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.177 -0.952 . . . . 0.0 110.023 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -61.6 -41.63 97.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 109.991 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 50.27 56.19 17.29 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.367 -0.833 . . . . 0.0 110.346 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 155.9 58.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 O-C-N 123.713 1.375 . . . . 0.0 110.459 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.46 -21.51 26.01 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.721 1.379 . . . . 0.0 110.6 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.7 119.35 15.02 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.179 -0.951 . . . . 0.0 110.305 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.93 -30.15 35.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.147 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -51.58 -65.99 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ASP . . . . . 0.406 ' OD1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 t70 -55.35 -42.94 74.53 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.444 -0.785 . . . . 0.0 109.941 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -58.13 -50.36 73.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.242 -0.911 . . . . 0.0 109.897 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.24 -40.29 64.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.396 -0.815 . . . . 0.0 110.426 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.56 HG13 ' OG1' ' A' ' 39' ' ' THR . 93.3 t -74.08 -46.23 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.35 -24.27 67.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.172 -0.955 . . . . 0.0 110.294 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -73.29 -67.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.427 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.42 ' HB3' HG23 ' A' ' 35' ' ' VAL . 29.2 m-85 -59.68 -50.46 73.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.267 -0.895 . . . . 0.0 110.443 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.552 ' OG1' HG13 ' A' ' 35' ' ' VAL . 98.8 m -50.15 -33.83 20.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.074 -1.016 . . . . 0.0 110.205 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -75.27 -25.27 57.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.219 -0.925 . . . . 0.0 109.79 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -38.01 89.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.327 -0.858 . . . . 0.0 109.803 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH1' ' OD1' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -50.88 -39.9 55.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.362 -0.836 . . . . 0.0 110.155 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -76.54 -25.19 53.84 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.35 -0.843 . . . . 0.0 110.234 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.13 -67.22 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.251 -0.906 . . . . 0.0 110.259 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -51.0 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.473 -0.767 . . . . 0.0 110.423 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.13 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.0 m-70 . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.281 0.562 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 38.9 ttm -81.63 -27.22 34.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.94 -149.62 6.07 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.2 p-80 -155.85 37.2 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.243 -1.151 . . . . 0.0 110.186 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.416 ' O ' HG23 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -113.14 134.01 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.327 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.33 53.48 0.55 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.268 -0.895 . . . . 0.0 110.175 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -122.94 94.86 46.91 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.151 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.17 139.38 29.37 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.569 1.299 . . . . 0.0 110.407 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.84 -169.63 0.58 Allowed 'Trans proline' 0 C--N 1.312 -1.381 0 O-C-N 123.528 1.278 . . . . 0.0 110.524 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.53 -43.74 1.77 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.788 ' O ' HD23 ' A' ' 11' ' ' LEU . 2.9 tt -73.36 -27.26 61.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.191 -1.182 . . . . 0.0 110.29 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 41.2 m -65.22 -47.29 77.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.238 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -57.63 -33.81 68.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 -58.78 4.27 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 73.4 mt -56.55 -41.58 77.11 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.213 -0.929 . . . . 0.0 109.774 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -41.06 59.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.185 -0.947 . . . . 0.0 109.779 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 21' ' ' GLU . . . -56.61 -61.35 7.58 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.652 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 2.2 t80 -48.64 -47.73 40.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.459 -1.024 . . . . 0.0 110.506 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.1 -54.41 25.24 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.092 -1.005 . . . . 0.0 108.879 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.29 -44.86 99.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -51.27 -65.07 0.62 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-O 121.478 0.656 . . . . 0.0 110.685 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 18' ' ' TYR . 21.1 t -54.95 -29.29 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.591 -0.693 . . . . 0.0 110.341 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -72.71 -25.57 61.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.087 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -104.49 -50.47 3.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.227 -0.921 . . . . 0.0 109.996 179.818 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -86.34 50.85 2.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.326 -0.859 . . . . 0.0 110.452 -179.893 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.35 96.09 0.11 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.826 -0.546 . . . . 0.0 111.121 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.414 ' CD ' ' O ' ' A' ' 25' ' ' GLN . 48.2 Cg_endo -89.92 153.42 4.93 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 124.004 1.529 . . . . 0.0 110.804 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.06 -27.93 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.694 1.365 . . . . 0.0 109.812 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.44 115.8 11.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.488 -0.758 . . . . 0.0 109.839 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.72 -38.26 83.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.261 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.8 t -53.6 -65.72 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.174 -0.954 . . . . 0.0 109.866 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -56.98 -34.73 68.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.359 -0.838 . . . . 0.0 109.964 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.471 ' HD2' ' HH ' ' A' ' 18' ' ' TYR . 64.9 t80 -66.75 -44.32 81.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 0.0 109.675 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.652 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -62.55 -30.56 71.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.314 -0.866 . . . . 0.0 109.958 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.402 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.8 t -76.55 -48.41 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.337 -0.852 . . . . 0.0 110.165 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.18 -26.3 64.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.477 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -78.25 -68.47 0.64 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.127 -0.983 . . . . 0.0 110.525 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -56.93 -45.3 82.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.237 -0.915 . . . . 0.0 110.528 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.42 ' OG1' HG13 ' B' ' 35' ' ' VAL . 99.7 m -53.55 -43.98 68.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.082 -1.011 . . . . 0.0 110.024 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -66.12 -32.08 73.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.323 -0.861 . . . . 0.0 110.116 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -64.9 -40.07 94.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.025 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -39.42 90.16 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -76.72 -21.98 54.52 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.336 -0.852 . . . . 0.0 110.296 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.3 -65.79 0.64 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.233 -0.917 . . . . 0.0 110.335 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -48.82 129.19 16.74 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.462 -0.774 . . . . 0.0 110.719 -179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.291 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 30.8 m-70 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.283 0.564 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 38.7 ttm -81.74 -27.18 33.99 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.905 . . . . 0.0 110.17 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.92 -149.58 6.05 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 37.7 p-80 -155.89 36.98 0.35 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -1.147 . . . . 0.0 110.101 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.428 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.9 OUTLIER -112.81 133.97 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.862 . . . . 0.0 110.433 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -156.35 53.43 0.55 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.303 -0.873 . . . . 0.0 110.287 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -122.83 94.81 47.07 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.268 -0.895 . . . . 0.0 110.206 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.16 139.32 29.32 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.662 1.348 . . . . 0.0 110.336 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.87 -169.53 0.57 Allowed 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.575 1.303 . . . . 0.0 110.478 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.34 -43.55 1.81 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.788 ' O ' HD23 ' B' ' 11' ' ' LEU . 2.9 tt -73.34 -27.28 61.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.229 -1.16 . . . . 0.0 110.299 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 39.9 m -65.22 -47.38 77.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.281 -0.887 . . . . 0.0 110.267 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -57.55 -33.93 68.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.86 -59.04 3.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 110.08 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -56.28 -41.68 76.26 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 109.801 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -40.93 59.74 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.077 -1.014 . . . . 0.0 109.891 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' B' ' 21' ' ' GLU . . . -56.55 -61.47 7.44 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.649 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 2.2 t80 -48.63 -47.83 39.93 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.392 -1.064 . . . . 0.0 110.517 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.02 -54.5 24.02 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.147 -0.971 . . . . 0.0 108.886 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.19 -44.71 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.2 OUTLIER -51.43 -64.98 0.64 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.564 0.697 . . . . 0.0 110.707 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.494 HG23 ' O ' ' B' ' 18' ' ' TYR . 21.1 t -54.99 -29.39 21.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.424 -0.798 . . . . 0.0 110.296 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -25.52 61.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.161 -0.962 . . . . 0.0 110.089 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.414 ' N ' ' HD2' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -104.62 -50.55 3.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.957 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.415 ' O ' ' N ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER -86.28 50.75 2.05 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.37 -0.831 . . . . 0.0 110.468 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.25 95.98 0.1 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.83 -0.543 . . . . 0.0 111.14 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.415 ' N ' ' O ' ' B' ' 25' ' ' GLN . 48.3 Cg_endo -89.86 153.48 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 124.014 1.534 . . . . 0.0 110.803 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.04 -28.12 19.58 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.733 1.386 . . . . 0.0 109.88 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.21 115.85 12.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.433 -0.792 . . . . 0.0 109.778 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.66 -38.34 83.64 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.4 t -53.63 -65.6 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -0.959 . . . . 0.0 109.929 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.08 -34.58 68.45 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.507 -0.745 . . . . 0.0 109.983 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.457 ' HD2' ' HH ' ' B' ' 18' ' ' TYR . 65.5 t80 -66.98 -43.85 81.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.649 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -62.89 -30.54 71.61 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.32 -0.862 . . . . 0.0 109.948 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.42 HG13 ' OG1' ' A' ' 39' ' ' THR . 87.8 t -76.43 -48.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.368 -0.833 . . . . 0.0 110.178 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -59.11 -26.4 64.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 110.473 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -78.12 -68.17 0.66 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.588 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -57.29 -45.43 84.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.206 -0.933 . . . . 0.0 110.426 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.409 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 99.7 m -53.43 -43.85 68.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.099 -1.001 . . . . 0.0 110.079 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -66.23 -31.98 73.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.091 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.03 -39.86 94.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.251 -0.906 . . . . 0.0 110.038 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -39.51 90.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 110.151 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -76.66 -21.9 54.78 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.265 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.4 -65.52 0.68 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.247 -0.908 . . . . 0.0 110.37 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.15 129.25 17.72 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.514 -0.741 . . . . 0.0 110.657 -179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 118.072 -0.966 . . . . 0.0 110.148 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 m80 . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.299 0.571 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.9 ptm -141.93 20.54 2.13 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.171 -0.955 . . . . 0.0 110.349 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.11 145.87 12.14 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.4 m80 -128.1 159.43 35.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.184 -1.186 . . . . 0.0 110.307 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.637 ' N ' HD12 ' A' ' 5' ' ' ILE . 5.3 mp -113.69 95.51 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.205 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.1 171.07 16.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.279 -0.888 . . . . 0.0 110.303 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.3 117.49 68.85 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.03 147.05 48.22 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.484 1.255 . . . . 0.0 110.515 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.07 143.57 32.65 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 O-C-N 123.778 1.41 . . . . 0.0 110.537 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.51 -20.45 44.41 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.11 -52.98 19.43 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 110.407 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.1 m -60.76 -49.95 75.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.877 . . . . 0.0 110.401 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.67 -45.57 66.84 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.324 -0.86 . . . . 0.0 110.407 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 14' ' ' LEU . 2.1 mt -56.08 -53.56 55.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.168 -0.957 . . . . 0.0 110.341 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.49 HD21 ' HD2' ' B' ' 18' ' ' TYR . 66.7 mt -62.73 -47.82 81.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.21 -0.931 . . . . 0.0 110.08 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.58 -34.55 58.75 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.236 -0.915 . . . . 0.0 109.719 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.77 -55.28 30.85 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.435 ' HD2' HD21 ' B' ' 15' ' ' LEU . 1.6 t80 -47.39 -43.66 23.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.504 -0.998 . . . . 0.0 110.404 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.4 m -55.9 -36.12 67.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.431 -0.793 . . . . 0.0 110.265 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.7 t -82.41 -25.35 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 110.543 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.8 mt-10 -85.32 -54.12 4.8 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.13 -0.981 . . . . 0.0 108.886 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.9 t -53.75 -39.15 37.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 CA-C-O 121.219 0.533 . . . . 0.0 110.308 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.508 HD12 ' O ' ' A' ' 19' ' ' THR . 12.1 mt -70.99 -40.4 71.88 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -65.42 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.236 -0.915 . . . . 0.0 110.242 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.13 65.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.177 -0.952 . . . . 0.0 110.081 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.96 58.58 16.81 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.318 -0.864 . . . . 0.0 110.566 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.54 146.89 50.63 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.627 1.33 . . . . 0.0 110.303 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.66 -30.77 17.6 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.63 1.332 . . . . 0.0 110.536 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -133.6 121.21 21.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 110.241 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.5 -25.04 41.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.065 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.679 HG12 ' HD2' ' B' ' 42' ' ' ARG . 41.0 t -54.34 -53.71 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.211 -0.931 . . . . 0.0 109.793 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.38 -47.44 60.9 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.584 -0.697 . . . . 0.0 109.934 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -58.13 -50.51 73.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.224 -0.922 . . . . 0.0 109.577 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.464 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -53.78 -37.35 63.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.306 -0.871 . . . . 0.0 109.921 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.507 HG13 ' OG1' ' B' ' 39' ' ' THR . 68.8 t -79.31 -34.89 16.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.34 -0.85 . . . . 0.0 109.915 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.76 -22.75 49.76 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -79.76 -64.01 1.28 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.176 -0.952 . . . . 0.0 110.623 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.482 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 15.4 m-85 -59.43 -48.07 83.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.198 -0.939 . . . . 0.0 110.533 -179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.517 ' OG1' HG13 ' B' ' 35' ' ' VAL . 62.3 m -52.48 -50.57 62.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.041 -1.037 . . . . 0.0 110.052 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -58.79 -26.7 64.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.157 -0.965 . . . . 0.0 109.832 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.563 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 2.9 tp -61.63 -40.9 96.5 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.4 -0.813 . . . . 0.0 110.12 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.646 ' HD2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -52.55 -63.06 1.26 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -62.45 -19.97 64.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.907 . . . . 0.0 110.241 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 41' ' ' LEU . . . -66.7 -59.19 3.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.452 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -39.38 21.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.473 -0.767 . . . . 0.0 110.926 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.231 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 m80 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.18 0.514 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 23.9 ptm -141.74 20.54 2.16 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.449 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.01 145.76 12.01 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 15.6 m80 -128.02 159.27 35.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.26 -1.141 . . . . 0.0 110.346 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.635 HD12 ' N ' ' B' ' 5' ' ' ILE . 5.3 mp -113.53 95.39 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -0.895 . . . . 0.0 110.206 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -147.89 171.29 15.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.168 -0.958 . . . . 0.0 110.284 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.43 117.4 68.63 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.204 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.95 147.2 48.97 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.5 1.263 . . . . 0.0 110.429 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.21 143.56 32.08 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.693 1.364 . . . . 0.0 110.503 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.65 -20.59 43.6 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 tp -70.16 -52.81 20.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.093 -1.24 . . . . 0.0 110.422 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 85.7 m -60.86 -49.83 75.88 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.167 -0.958 . . . . 0.0 110.308 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.79 -45.54 67.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.0 110.37 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 14' ' ' LEU . 2.1 mt -56.1 -53.73 53.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.294 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.435 HD21 ' HD2' ' A' ' 18' ' ' TYR . 66.4 mt -62.63 -47.89 81.77 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.912 . . . . 0.0 110.022 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.55 -34.63 58.92 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.15 -0.969 . . . . 0.0 109.659 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.69 -55.29 30.74 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.85 -1.7 . . . . 0.0 108.85 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.49 ' HD2' HD21 ' A' ' 15' ' ' LEU . 1.6 t80 -47.43 -43.56 23.95 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.375 -1.074 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.512 ' O ' HD12 ' B' ' 23' ' ' LEU . 2.4 m -56.09 -35.92 67.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.531 -0.731 . . . . 0.0 110.254 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.46 -25.53 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.26 -0.9 . . . . 0.0 110.476 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.421 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 1.8 mt-10 -85.22 -54.06 4.85 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 108.877 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 95.6 t -53.82 -39.04 37.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.859 -0.526 . . . . 0.0 110.249 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.512 HD12 ' O ' ' B' ' 19' ' ' THR . 12.2 mt -71.1 -40.53 71.45 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.235 -0.915 . . . . 0.0 110.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.04 -65.48 0.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 110.266 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.26 -31.09 65.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.203 -0.936 . . . . 0.0 110.015 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.93 58.56 16.83 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.525 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.37 146.96 51.73 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.691 1.364 . . . . 0.0 110.339 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.71 -31.01 17.04 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.685 1.361 . . . . 0.0 110.52 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -133.43 121.34 22.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.274 -0.891 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.52 -25.16 41.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 110.067 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.646 HG12 ' HD2' ' A' ' 42' ' ' ARG . 41.6 t -54.22 -53.73 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.768 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.42 -47.37 61.05 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.598 -0.689 . . . . 0.0 109.952 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -58.2 -50.33 73.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 109.619 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.482 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -53.87 -37.51 63.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.345 -0.847 . . . . 0.0 109.881 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.517 HG13 ' OG1' ' A' ' 39' ' ' THR . 72.2 t -79.13 -34.78 16.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 O-C-N 121.341 -0.85 . . . . 0.0 110.019 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.94 -22.64 49.23 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.314 -0.866 . . . . 0.0 109.669 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -79.75 -64.24 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.218 -0.926 . . . . 0.0 110.586 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.464 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 15.2 m-85 -59.21 -47.98 83.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.184 -0.947 . . . . 0.0 110.683 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.507 ' OG1' HG13 ' A' ' 35' ' ' VAL . 61.0 m -52.76 -50.37 63.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.956 -1.09 . . . . 0.0 110.051 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -59.0 -26.65 64.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.857 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.574 ' O ' ' HB3' ' B' ' 44' ' ' ALA . 2.9 tp -61.67 -40.87 96.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 110.04 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.679 ' HD2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -52.45 -63.21 1.22 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.283 -0.886 . . . . 0.0 110.193 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -62.29 -20.15 64.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' B' ' 41' ' ' LEU . . . -66.51 -59.31 3.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.197 -0.939 . . . . 0.0 110.435 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.37 -39.23 21.55 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.517 -0.74 . . . . 0.0 110.906 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.253 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 24.9 p80 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.194 0.521 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 14.3 ttp -73.68 108.65 6.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.178 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.97 165.47 16.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.12 176.32 7.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.304 -1.115 . . . . 0.0 110.261 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.693 ' N ' HD12 ' A' ' 5' ' ' ILE . 4.7 mp -109.14 110.33 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.235 -0.916 . . . . 0.0 110.251 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -113.85 83.95 1.95 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.868 . . . . 0.0 110.167 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.627 HD12 ' C ' ' A' ' 7' ' ' ILE . 2.3 pp -65.72 147.82 98.52 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.919 . . . . 0.0 110.183 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.01 119.25 6.06 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.732 1.385 . . . . 0.0 110.495 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.11 158.73 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.529 1.278 . . . . 0.0 110.362 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.17 -35.51 4.98 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.16 -29.16 70.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 110.214 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.9 m -56.77 -45.73 81.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.9 . . . . 0.0 110.123 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 -36.92 79.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -0.846 . . . . 0.0 110.366 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.33 -47.9 53.72 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.2 -0.938 . . . . 0.0 110.232 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.41 ' HA ' HD13 ' A' ' 15' ' ' LEU . 0.7 OUTLIER -65.36 -58.2 6.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.075 -1.015 . . . . 0.0 110.102 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.4 -24.69 5.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.155 -0.966 . . . . 0.0 109.903 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -65.94 -57.41 10.89 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.6 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t80 -48.54 -35.8 14.07 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.384 -1.068 . . . . 0.0 110.312 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.01 -39.17 93.96 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.42 -0.8 . . . . 0.0 110.065 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.423 ' O ' ' CB ' ' A' ' 24' ' ' ARG . 92.2 t -80.88 -21.52 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 110.798 -179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.4 OUTLIER -86.95 -55.05 4.01 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.065 -1.022 . . . . 0.0 109.333 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 18' ' ' TYR . 29.0 t -56.85 -31.18 35.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.722 -0.611 . . . . 0.0 110.389 -179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.454 ' HA ' HD23 ' A' ' 23' ' ' LEU . 32.4 mt -87.43 -42.0 13.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.218 -0.926 . . . . 0.0 110.34 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -71.9 -53.27 13.69 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.143 -0.973 . . . . 0.0 110.262 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.31 -35.35 63.66 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.191 -0.943 . . . . 0.0 109.855 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.3 64.07 8.97 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.476 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.39 151.29 65.38 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.741 1.39 . . . . 0.0 110.527 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.36 -22.52 25.05 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.733 1.386 . . . . 0.0 110.272 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.73 116.31 14.75 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.261 -0.9 . . . . 0.0 110.13 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.538 HD11 ' CE2' ' A' ' 18' ' ' TYR . 7.5 tp -80.53 -34.2 35.73 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 110.307 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 31' ' ' VAL . 48.4 t -51.67 -66.21 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.208 -0.932 . . . . 0.0 110.142 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.15 -40.5 67.49 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.428 -0.795 . . . . 0.0 109.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.9 -54.98 38.44 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.36 -0.838 . . . . 0.0 109.763 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.519 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -53.0 -38.55 62.4 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.575 HG13 ' OG1' ' B' ' 39' ' ' THR . 81.6 t -77.37 -27.09 15.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.293 -0.879 . . . . 0.0 109.837 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.99 -51.94 7.54 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.334 -0.854 . . . . 0.0 109.868 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -56.71 -63.17 1.29 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 110.786 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CG ' ' HB1' ' B' ' 34' ' ' ALA . 15.9 m-85 -53.89 -52.31 60.93 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 111.008 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.584 ' OG1' HG13 ' B' ' 35' ' ' VAL . 22.3 m -53.36 -24.93 13.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.933 -1.104 . . . . 0.0 110.086 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -25.56 43.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.929 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.6 -25.35 60.29 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.04 -29.1 64.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.262 -0.899 . . . . 0.0 109.629 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -66.43 -35.28 79.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.32 -0.862 . . . . 0.0 110.184 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.11 -65.41 0.69 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.251 -0.906 . . . . 0.0 110.323 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -49.73 -71.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.611 -0.681 . . . . 0.0 110.686 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.293 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 25.2 p80 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.234 0.54 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 14.1 ttp -73.71 108.46 6.57 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.209 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.74 165.5 16.53 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.25 176.23 7.84 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -1.153 . . . . 0.0 110.279 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.682 HD12 ' N ' ' B' ' 5' ' ' ILE . 4.7 mp -109.05 110.26 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.303 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -113.73 83.75 1.91 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 110.21 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.638 ' C ' HD12 ' B' ' 7' ' ' ILE . 2.3 pp -65.69 147.87 98.48 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.204 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.02 119.28 6.08 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.705 1.371 . . . . 0.0 110.393 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.18 158.79 53.93 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.49 1.258 . . . . 0.0 110.38 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.19 -35.45 5.02 Favored Glycine 0 N--CA 1.489 2.17 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.1 -29.32 70.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -1.148 . . . . 0.0 110.212 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 93.9 m -56.66 -45.68 81.5 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.249 -0.907 . . . . 0.0 110.239 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -36.79 79.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.364 -0.835 . . . . 0.0 110.281 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.53 -47.79 52.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.273 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -65.27 -58.2 6.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 110.214 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.52 -24.65 5.45 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.21 -0.931 . . . . 0.0 109.858 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -65.81 -57.61 10.67 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.598 ' O ' HG23 ' B' ' 22' ' ' VAL . 1.1 t80 -48.44 -35.85 13.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.423 -1.045 . . . . 0.0 110.394 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.02 -39.19 94.02 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.479 -0.763 . . . . 0.0 110.039 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' B' ' 24' ' ' ARG . 92.9 t -80.76 -21.57 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.952 . . . . 0.0 110.825 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.4 OUTLIER -86.97 -55.14 3.96 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.014 -1.053 . . . . 0.0 109.269 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.598 HG23 ' O ' ' B' ' 18' ' ' TYR . 29.1 t -56.79 -31.07 34.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.716 -0.615 . . . . 0.0 110.475 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' B' ' 23' ' ' LEU . 32.0 mt -87.51 -42.14 12.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.0 110.29 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.419 ' CB ' ' O ' ' B' ' 20' ' ' VAL . 0.2 OUTLIER -71.88 -53.2 13.93 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 110.241 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.29 -35.4 63.72 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.202 -0.936 . . . . 0.0 109.763 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.28 64.14 8.86 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.323 -0.861 . . . . 0.0 110.441 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.56 151.32 64.42 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.675 1.355 . . . . 0.0 110.449 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.41 -22.36 25.08 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.714 1.376 . . . . 0.0 110.313 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.81 116.4 14.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 110.067 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.536 HD11 ' CE2' ' B' ' 18' ' ' TYR . 7.7 tp -80.67 -34.32 34.89 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.365 -0.835 . . . . 0.0 110.261 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.403 ' H ' HG23 ' B' ' 31' ' ' VAL . 48.5 t -51.59 -66.33 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.271 -0.893 . . . . 0.0 110.038 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.03 -40.57 67.19 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.543 -0.723 . . . . 0.0 109.831 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -60.79 -55.09 37.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.409 -0.807 . . . . 0.0 109.688 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.514 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.96 -38.25 61.89 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.395 -0.816 . . . . 0.0 109.997 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.584 HG13 ' OG1' ' A' ' 39' ' ' THR . 81.1 t -77.73 -26.76 15.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 O-C-N 121.248 -0.907 . . . . 0.0 109.838 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -82.3 -51.96 7.39 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.275 -0.891 . . . . 0.0 109.772 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -56.85 -63.01 1.35 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 0.0 110.715 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -54.15 -52.1 62.2 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.926 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.575 ' OG1' HG13 ' A' ' 35' ' ' VAL . 22.4 m -53.37 -25.2 14.49 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.08 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -25.91 43.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 109.84 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.14 -25.41 60.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.242 -0.911 . . . . 0.0 110.03 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -28.99 64.73 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.371 -0.83 . . . . 0.0 109.672 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.43 -35.23 79.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.199 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.3 -65.24 0.71 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.321 -0.862 . . . . 0.0 110.291 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -49.97 -71.22 0.07 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.492 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.098 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.6 ttt 53.11 76.73 0.19 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.311 -0.868 . . . . 0.0 110.217 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.82 105.78 0.2 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -128.02 -70.27 0.7 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.232 -1.158 . . . . 0.0 110.329 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.1 tp -112.58 142.53 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 110.386 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -167.42 60.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.403 -0.811 . . . . 0.0 110.103 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.631 HD12 ' C ' ' A' ' 7' ' ' ILE . 2.2 pp -126.9 158.0 69.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.933 . . . . 0.0 110.259 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.35 115.99 4.54 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 O-C-N 123.82 1.432 . . . . 0.0 110.54 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.13 151.58 49.7 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.521 1.274 . . . . 0.0 110.319 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.03 -32.23 4.84 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.54 -27.1 60.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.257 -1.143 . . . . 0.0 110.239 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.09 -61.64 2.31 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.57 -48.37 57.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 0.0 110.371 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.68 -57.91 10.01 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.291 -0.88 . . . . 0.0 110.153 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -60.69 -38.55 85.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -54.09 -42.85 69.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.091 -1.005 . . . . 0.0 109.754 179.7 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.417 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -56.49 -56.23 25.58 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.844 -1.702 . . . . 0.0 108.844 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.635 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -47.09 -45.86 22.31 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.467 -1.019 . . . . 0.0 110.423 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -61.22 -32.89 72.67 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -0.767 . . . . 0.0 109.86 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 16' ' ' GLN . 48.0 t -82.72 -26.99 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.871 . . . . 0.0 110.664 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -80.12 -59.21 2.8 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.089 -1.007 . . . . 0.0 109.016 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.47 HG11 HD21 ' B' ' 11' ' ' LEU . 20.7 t -54.93 -32.94 27.51 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.883 -0.511 . . . . 0.0 109.8 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.26 -19.86 42.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.082 -1.011 . . . . 0.0 110.215 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.15 -49.45 8.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -0.921 . . . . 0.0 110.504 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.437 ' CG ' ' HD3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -99.99 -23.59 14.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.22 -0.925 . . . . 0.0 110.678 -179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 49.67 71.04 1.7 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.437 ' HD3' ' CG ' ' A' ' 25' ' ' GLN . 44.6 Cg_endo -71.2 154.09 61.96 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.679 1.357 . . . . 0.0 110.379 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.02 -42.14 3.37 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.358 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -110.16 114.64 28.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.26 -0.9 . . . . 0.0 110.152 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.17 -33.75 22.23 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.866 . . . . 0.0 109.93 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.9 t -52.9 -64.79 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 0.0 109.799 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.532 -0.73 . . . . 0.0 109.828 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -53.96 -47.1 71.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.842 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.635 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.34 -46.94 66.3 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.316 -0.865 . . . . 0.0 109.945 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.466 HG23 ' HB3' ' B' ' 38' ' ' PHE . 94.8 t -62.76 -49.12 84.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 O-C-N 121.206 -0.934 . . . . 0.0 109.871 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.42 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -51.28 -56.48 12.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.383 -0.823 . . . . 0.0 110.531 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -53.35 -63.81 1.03 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.452 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 22.8 m-85 -58.29 -53.45 58.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 110.479 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 90.3 m -51.52 -33.66 32.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.138 -0.976 . . . . 0.0 110.164 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.87 -29.83 44.7 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.0 109.979 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.62 -34.79 69.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 110.086 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -31.5 69.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.262 -0.899 . . . . 0.0 110.162 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -100.03 -30.94 11.69 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.206 -0.934 . . . . 0.0 110.204 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 46' ' ' ARG . . . -60.88 -77.21 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.915 . . . . 0.0 110.26 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.9 -90.74 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.792 -0.568 . . . . 0.0 110.955 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 O-C-N 120.86 -1.15 . . . . 0.0 110.207 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.244 0.545 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 19.6 ttt 53.15 76.58 0.2 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.221 -0.924 . . . . 0.0 110.269 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.95 105.88 0.2 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -128.04 -70.26 0.7 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.245 -1.15 . . . . 0.0 110.35 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.1 tp -112.51 142.52 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.231 -0.918 . . . . 0.0 110.369 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -167.41 60.74 0.08 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.129 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.63 ' C ' HD12 ' B' ' 7' ' ' ILE . 2.2 pp -126.88 158.04 69.74 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.257 -0.902 . . . . 0.0 110.289 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.35 115.9 4.5 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.789 1.415 . . . . 0.0 110.527 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.01 151.51 50.25 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.471 1.248 . . . . 0.0 110.423 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.96 -32.03 4.92 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -74.59 -27.08 60.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -1.149 . . . . 0.0 110.19 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.04 -61.88 2.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.226 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.34 -48.32 55.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.824 . . . . 0.0 110.454 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.72 -58.02 9.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.55 -38.44 84.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.307 -0.871 . . . . 0.0 110.314 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.598 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -54.24 -42.81 70.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.059 -1.025 . . . . 0.0 109.76 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.418 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -56.6 -56.16 26.06 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.636 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.4 t80 -47.16 -45.79 23.04 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.519 -0.989 . . . . 0.0 110.4 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -61.33 -32.66 72.54 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.52 -0.737 . . . . 0.0 109.963 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.598 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.2 t -82.78 -27.1 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 110.599 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' B' ' 17' ' ' GLY . 1.0 OUTLIER -80.06 -59.24 2.79 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.133 -0.979 . . . . 0.0 109.083 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.476 HG23 ' O ' ' B' ' 18' ' ' TYR . 20.5 t -54.97 -32.71 27.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.801 -0.562 . . . . 0.0 109.857 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.51 -19.79 41.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 0.0 110.134 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -49.48 8.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.252 -0.905 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.435 ' CG ' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -99.98 -23.69 14.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.24 -0.912 . . . . 0.0 110.671 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 49.75 70.97 1.73 Allowed Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.079 -1.013 . . . . 0.0 110.519 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.435 ' HD3' ' CG ' ' B' ' 25' ' ' GLN . 44.4 Cg_endo -71.16 153.93 62.21 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.689 1.363 . . . . 0.0 110.364 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.99 -42.02 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 123.672 1.354 . . . . 0.0 110.299 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -110.36 114.5 28.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.908 . . . . 0.0 110.13 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.99 -33.84 22.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.229 -0.919 . . . . 0.0 109.969 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.0 t -52.82 -64.76 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.327 -0.858 . . . . 0.0 109.837 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.87 -45.86 82.22 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -54.13 -47.2 72.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.245 -0.909 . . . . 0.0 109.807 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.636 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.26 -46.83 65.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 0.0 109.969 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 38' ' ' PHE . 99.3 t -62.96 -49.0 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.278 -0.889 . . . . 0.0 109.873 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.423 ' OE1' ' N ' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -51.32 -56.47 12.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.477 -0.764 . . . . 0.0 110.519 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -53.25 -64.18 0.9 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.0 110.424 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.479 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 23.1 m-85 -58.01 -53.28 60.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.205 -0.935 . . . . 0.0 110.534 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.425 ' OG1' HG13 ' A' ' 35' ' ' VAL . 89.5 m -51.69 -33.63 34.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.075 -1.016 . . . . 0.0 110.113 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -29.88 44.35 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.273 -0.892 . . . . 0.0 110.024 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.45 -35.06 69.65 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.856 . . . . 0.0 110.071 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.73 -31.63 69.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.264 -0.897 . . . . 0.0 110.14 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -99.98 -30.82 11.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.252 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.442 ' O ' ' N ' ' B' ' 46' ' ' ARG . . . -60.98 -77.23 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.282 -0.886 . . . . 0.0 110.269 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.81 -90.79 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.874 -0.516 . . . . 0.0 110.979 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' B' ' 44' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 120.842 -1.161 . . . . 0.0 110.265 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 m170 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.211 0.529 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.4 mtm 53.32 178.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.301 -0.874 . . . . 0.0 110.26 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.75 112.08 3.46 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.1 t-80 -116.26 48.07 1.31 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -1.171 . . . . 0.0 110.145 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -116.05 75.96 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.262 -0.899 . . . . 0.0 110.368 -179.833 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -132.44 72.6 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.28 -0.888 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -102.67 132.41 21.32 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.321 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.62 121.24 6.59 Favored 'Trans proline' 0 C--N 1.313 -1.342 0 O-C-N 123.492 1.259 . . . . 0.0 110.197 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.07 162.08 39.65 Favored 'Trans proline' 0 C--N 1.312 -1.366 0 O-C-N 123.424 1.223 . . . . 0.0 110.599 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.87 -33.92 5.57 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -32.47 49.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -1.126 . . . . 0.0 110.371 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -59.47 -56.09 26.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.95 . . . . 0.0 110.261 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -51.93 -30.08 22.95 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.366 -0.834 . . . . 0.0 110.383 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.6 tp -69.85 -56.94 5.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.155 -0.966 . . . . 0.0 110.174 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.84 -46.06 89.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.163 -0.961 . . . . 0.0 110.191 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.76 -33.86 50.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.257 -0.902 . . . . 0.0 109.881 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -61.16 -57.63 17.53 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.544 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.1 t80 -45.13 -35.89 3.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.897 . . . . 0.0 110.711 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.665 ' O ' HD23 ' A' ' 23' ' ' LEU . 31.9 m -67.98 -35.1 77.79 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.825 . . . . 0.0 109.952 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.43 -24.38 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.218 -0.926 . . . . 0.0 110.4 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -76.9 -56.71 4.36 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.07 -1.019 . . . . 0.0 108.679 179.501 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 18' ' ' TYR . 46.0 t -56.35 -35.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 121.188 0.518 . . . . 0.0 110.245 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.665 HD23 ' O ' ' A' ' 19' ' ' THR . 3.8 mm? -73.73 -23.11 59.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.255 -0.903 . . . . 0.0 110.377 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.17 -65.39 1.02 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.249 -0.907 . . . . 0.0 110.764 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.79 -29.11 55.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.162 -0.961 . . . . 0.0 110.574 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 53.08 76.81 0.49 Allowed Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 0.0 110.055 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.97 156.69 55.93 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.727 1.382 . . . . 0.0 110.558 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.17 -33.5 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.769 1.405 . . . . 0.0 110.404 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -127.86 116.03 19.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.349 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.419 HD11 ' CE2' ' A' ' 18' ' ' TYR . 11.4 tp -74.35 -44.68 51.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.328 -0.858 . . . . 0.0 110.059 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.436 ' H ' HG23 ' A' ' 31' ' ' VAL . 43.1 t -50.61 -60.85 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.367 -0.833 . . . . 0.0 109.896 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.86 -37.92 77.59 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.629 -0.669 . . . . 0.0 109.945 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 27.8 t80 -62.57 -51.61 66.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.28 -0.888 . . . . 0.0 109.699 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.528 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -36.76 56.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.494 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.7 t -73.94 -51.55 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 O-C-N 121.207 -0.933 . . . . 0.0 110.173 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.24 -29.82 69.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.195 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.428 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 74.5 t80 -78.24 -67.39 0.74 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.283 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -51.69 -44.53 63.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.275 -0.89 . . . . 0.0 110.309 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.479 ' OG1' HG13 ' B' ' 35' ' ' VAL . 47.4 m -54.62 -44.56 73.24 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.724 179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -71.49 -27.15 63.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.332 -0.855 . . . . 0.0 109.814 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.856 . . . . 0.0 110.027 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.67 -26.71 60.03 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.284 -0.885 . . . . 0.0 109.848 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -103.77 13.78 32.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 110.485 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.67 -69.59 0.76 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.16 -0.962 . . . . 0.0 110.239 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.14 -55.21 10.88 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.571 -0.705 . . . . 0.0 110.454 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.211 179.897 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 m170 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.22 0.533 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 5.4 mtm 53.38 178.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 110.281 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.88 112.38 3.51 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -116.52 48.02 1.34 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -1.142 . . . . 0.0 110.111 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.629 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -115.96 75.71 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 110.441 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -132.14 72.56 1.5 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.221 -0.924 . . . . 0.0 110.044 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -102.65 132.27 21.48 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.351 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.5 121.2 6.6 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 123.519 1.273 . . . . 0.0 110.289 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.1 162.02 39.71 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.441 1.232 . . . . 0.0 110.542 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.85 -33.7 5.73 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.45 -32.48 48.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.201 -1.176 . . . . 0.0 110.41 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.2 m -59.4 -56.17 25.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.167 -0.958 . . . . 0.0 110.327 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.9 -29.86 21.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.321 -0.862 . . . . 0.0 110.463 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.11 -56.79 5.99 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.98 -45.93 90.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.936 . . . . 0.0 110.187 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.79 -34.08 51.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.312 -0.867 . . . . 0.0 109.846 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -61.25 -57.53 17.9 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.542 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 2.1 t80 -45.01 -36.12 3.28 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.566 -0.961 . . . . 0.0 110.623 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.649 ' O ' HD23 ' B' ' 23' ' ' LEU . 33.6 m -67.77 -35.14 78.16 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.437 -0.789 . . . . 0.0 110.04 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.45 -24.39 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.236 -0.915 . . . . 0.0 110.399 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.445 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -76.89 -56.65 4.4 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.184 -0.948 . . . . 0.0 108.698 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 18' ' ' TYR . 46.3 t -56.29 -36.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 121.206 0.526 . . . . 0.0 110.188 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.649 HD23 ' O ' ' B' ' 19' ' ' THR . 3.8 mm? -73.51 -23.0 59.97 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.32 -65.36 1.02 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.211 -0.931 . . . . 0.0 110.71 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.89 -28.94 55.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.175 -0.953 . . . . 0.0 110.659 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 52.98 76.95 0.48 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.109 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.11 156.68 55.39 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.765 1.403 . . . . 0.0 110.637 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.12 -33.37 11.74 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.779 1.41 . . . . 0.0 110.448 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -128.12 116.12 19.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 110.259 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.42 HD11 ' CE2' ' B' ' 18' ' ' TYR . 11.4 tp -74.47 -44.66 50.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.217 -0.927 . . . . 0.0 110.023 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.422 HG23 ' H ' ' B' ' 31' ' ' VAL . 43.9 t -50.74 -60.88 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.242 -0.911 . . . . 0.0 109.859 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.61 -37.9 76.84 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.584 -0.698 . . . . 0.0 109.853 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.41 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 27.9 t80 -62.87 -51.35 67.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.304 -0.872 . . . . 0.0 109.654 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.542 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.84 -36.5 58.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.001 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.479 HG13 ' OG1' ' A' ' 39' ' ' THR . 95.6 t -74.18 -51.55 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.262 -0.898 . . . . 0.0 110.059 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.31 -29.39 68.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.253 -0.904 . . . . 0.0 110.377 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.445 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 74.4 t80 -78.53 -67.27 0.76 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.186 -0.946 . . . . 0.0 110.261 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -51.8 -44.54 63.52 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.494 ' OG1' HG13 ' A' ' 35' ' ' VAL . 47.1 m -54.5 -44.53 72.79 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.161 -0.962 . . . . 0.0 109.717 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -71.84 -26.81 62.52 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 109.83 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -63.09 -25.26 68.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 110.037 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.84 -26.68 59.87 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 109.744 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -103.74 13.73 32.46 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 110.448 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.68 -69.54 0.76 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.157 -0.964 . . . . 0.0 110.261 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.34 -55.15 11.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.58 -0.7 . . . . 0.0 110.443 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.068 179.828 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.199 0.523 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -160.23 101.01 1.39 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.265 -0.897 . . . . 0.0 110.144 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.17 -134.41 6.28 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.482 ' C ' HD12 ' A' ' 5' ' ' ILE . 7.6 m-70 -130.74 154.05 48.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.192 -1.181 . . . . 0.0 110.29 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.68 ' N ' HD12 ' A' ' 5' ' ' ILE . 5.2 mp -125.96 149.45 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.274 -0.891 . . . . 0.0 110.099 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -121.55 47.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.198 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.2 mm -114.18 124.77 30.28 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.248 -0.907 . . . . 0.0 110.186 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.15 139.53 32.64 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.424 1.223 . . . . 0.0 110.466 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.25 173.84 13.07 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.588 1.31 . . . . 0.0 110.387 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.16 -35.27 4.34 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.506 HD23 ' C ' ' A' ' 11' ' ' LEU . 9.7 tt -75.04 -32.33 61.53 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -1.102 . . . . 0.0 110.094 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.2 m -62.67 -49.47 75.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.0 110.126 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -54.75 -49.96 69.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 110.257 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.85 -50.0 70.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.353 -0.842 . . . . 0.0 110.327 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.487 HD13 ' HA ' ' A' ' 15' ' ' LEU . 1.5 mm? -56.1 -52.44 64.29 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 110.177 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.464 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -52.28 -33.71 43.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.127 -0.983 . . . . 0.0 109.804 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.425 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.88 -55.45 30.49 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 108.803 -1.719 . . . . 0.0 108.803 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.453 ' CE2' HD11 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -49.78 -45.43 49.72 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.366 -1.079 . . . . 0.0 110.396 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 85.3 m -59.08 -35.77 73.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.401 -0.812 . . . . 0.0 110.069 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 16' ' ' GLN . 85.4 t -76.66 -27.06 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.484 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -85.23 -64.22 1.19 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.2 -0.937 . . . . 0.0 109.338 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.408 ' H ' HG23 ' A' ' 22' ' ' VAL . 39.3 t -50.55 -25.76 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.752 -0.592 . . . . 0.0 110.451 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 19' ' ' THR . 19.6 tp -88.36 -25.64 22.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.244 -0.91 . . . . 0.0 110.205 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.64 -56.38 3.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.159 -0.963 . . . . 0.0 110.529 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 26' ' ' GLN . 5.9 pt20 -85.32 -27.03 26.19 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.075 -1.016 . . . . 0.0 110.581 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.463 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.3 OUTLIER 47.87 80.68 0.28 Allowed Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 0.0 110.632 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.74 161.66 44.46 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.622 1.327 . . . . 0.0 110.547 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.3 -36.02 7.64 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.736 1.387 . . . . 0.0 110.236 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -130.08 113.8 14.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.308 -0.87 . . . . 0.0 110.001 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.453 HD11 ' CE2' ' A' ' 18' ' ' TYR . 4.3 tp -67.2 -36.56 81.99 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.0 110.367 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.417 ' H ' HG23 ' A' ' 31' ' ' VAL . 44.0 t -51.3 -65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.216 -0.927 . . . . 0.0 110.091 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.24 -40.87 68.14 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.527 -0.733 . . . . 0.0 109.997 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.5 -46.71 89.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.771 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.666 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -57.78 -44.44 86.23 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.145 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.574 HG13 ' OG1' ' B' ' 39' ' ' THR . 99.0 t -69.91 -34.49 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.301 -0.874 . . . . 0.0 110.021 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.5 40.12 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.279 -0.888 . . . . 0.0 109.751 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 16.1 t80 -76.58 -68.48 0.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.158 -0.964 . . . . 0.0 110.291 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.679 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 17.2 m-85 -51.67 -50.31 60.67 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.224 -0.922 . . . . 0.0 110.575 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.576 ' OG1' HG13 ' B' ' 35' ' ' VAL . 51.8 m -53.14 -39.07 63.24 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.949 -1.094 . . . . 0.0 110.054 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -73.01 -27.21 61.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.33 -0.856 . . . . 0.0 109.989 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.76 -35.47 76.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.358 -0.839 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.1 -38.2 70.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.268 -0.895 . . . . 0.0 110.222 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -71.03 -13.29 61.94 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.223 -0.923 . . . . 0.0 110.576 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.04 -64.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.066 -1.021 . . . . 0.0 110.475 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -47.98 -30.19 4.09 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.454 -0.779 . . . . 0.0 110.844 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.238 179.952 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.256 0.551 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -160.03 101.02 1.42 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.237 -0.914 . . . . 0.0 110.152 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.1 -134.47 6.31 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' HIS . . . . . 0.48 ' C ' HD12 ' B' ' 5' ' ' ILE . 7.6 m-70 -130.8 153.85 48.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -1.128 . . . . 0.0 110.287 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.676 HD12 ' N ' ' B' ' 5' ' ' ILE . 5.3 mp -125.84 149.45 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.166 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -121.6 47.95 1.77 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.319 -0.863 . . . . 0.0 110.211 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.3 mm -114.26 124.64 30.45 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.19 139.51 32.5 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 123.393 1.207 . . . . 0.0 110.359 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.2 173.66 13.34 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.57 1.3 . . . . 0.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.43 -35.34 4.34 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.487 ' C ' HD23 ' B' ' 11' ' ' LEU . 9.8 tt -75.06 -32.32 61.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.326 -1.102 . . . . 0.0 110.113 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.8 m -62.58 -49.5 75.0 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.344 -0.848 . . . . 0.0 110.15 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -54.73 -49.97 69.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.848 . . . . 0.0 110.267 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.84 -50.13 70.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.264 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.448 ' HA ' HD13 ' B' ' 15' ' ' LEU . 1.5 mm? -56.02 -52.61 63.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.46 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.2 OUTLIER -51.97 -33.99 40.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.11 -0.994 . . . . 0.0 109.856 179.635 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -57.61 -55.6 29.59 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.88 -1.688 . . . . 0.0 108.88 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.469 ' CE2' HD11 ' B' ' 30' ' ' LEU . 1.0 OUTLIER -49.7 -45.53 49.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.417 -1.049 . . . . 0.0 110.395 179.535 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 84.8 m -58.94 -35.63 73.43 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.418 -0.801 . . . . 0.0 110.072 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.46 HG23 ' O ' ' B' ' 16' ' ' GLN . 83.9 t -76.92 -26.92 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.274 -0.891 . . . . 0.0 110.417 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.444 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -85.29 -64.21 1.19 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.109 -0.995 . . . . 0.0 109.357 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.423 HG23 ' H ' ' B' ' 22' ' ' VAL . 39.2 t -50.57 -25.68 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.716 -0.615 . . . . 0.0 110.329 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.414 ' CB ' ' O ' ' B' ' 19' ' ' THR . 19.9 tp -88.57 -25.53 22.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.118 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.83 -56.32 3.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.167 -0.958 . . . . 0.0 110.494 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.447 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 6.0 pt20 -85.36 -26.94 26.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.153 -0.967 . . . . 0.0 110.596 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.447 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 0.3 OUTLIER 47.86 80.65 0.28 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.177 -0.952 . . . . 0.0 110.524 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.414 ' HD3' ' HG3' ' B' ' 25' ' ' GLN . 45.7 Cg_endo -71.65 161.54 44.94 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.791 1.416 . . . . 0.0 110.567 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -36.09 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.67 1.353 . . . . 0.0 110.212 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -129.86 113.88 15.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -0.894 . . . . 0.0 110.001 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.469 HD11 ' CE2' ' B' ' 18' ' ' TYR . 4.3 tp -67.21 -36.51 81.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 110.374 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.41 HG23 ' H ' ' B' ' 31' ' ' VAL . 43.8 t -51.34 -65.4 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.255 -0.903 . . . . 0.0 110.09 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.52 -40.57 68.73 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.437 -0.79 . . . . 0.0 109.923 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -60.55 -47.0 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.22 -0.925 . . . . 0.0 109.755 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.679 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -57.36 -44.46 84.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.264 -0.898 . . . . 0.0 110.252 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.576 HG13 ' OG1' ' A' ' 39' ' ' THR . 98.1 t -70.06 -34.48 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.204 -0.935 . . . . 0.0 109.987 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.58 40.14 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.359 -0.838 . . . . 0.0 109.748 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.444 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 16.2 t80 -76.42 -68.44 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.981 . . . . 0.0 110.383 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.666 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 17.4 m-85 -51.84 -50.2 61.36 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.547 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.574 ' OG1' HG13 ' A' ' 35' ' ' VAL . 51.8 m -53.21 -38.99 63.38 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.082 -1.011 . . . . 0.0 110.047 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -73.08 -27.24 61.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.946 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -35.5 76.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.339 -0.851 . . . . 0.0 110.11 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.07 -38.34 70.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.174 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.88 -13.32 61.99 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.64 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.11 -64.25 1.1 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.436 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -48.15 -29.86 4.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.499 -0.751 . . . . 0.0 110.753 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.5 mtp180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.22 179.893 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.214 0.53 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mtm -110.39 105.27 14.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.2 -0.937 . . . . 0.0 110.283 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.69 100.63 2.34 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -143.97 152.01 40.5 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.294 -1.121 . . . . 0.0 110.251 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.405 HG13 ' N ' ' A' ' 6' ' ' GLN . 1.4 tp -120.39 150.11 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.2 -0.937 . . . . 0.0 110.303 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.405 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -172.57 91.46 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -0.915 . . . . 0.0 110.264 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.619 ' N ' HD12 ' A' ' 7' ' ' ILE . 1.8 mp -89.53 110.29 37.98 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.0 109.52 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.46 157.35 56.6 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.533 1.281 . . . . 0.0 110.819 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -75.23 164.41 32.99 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.733 1.386 . . . . 0.0 110.522 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.06 -23.79 32.46 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.759 HD11 HG11 ' B' ' 22' ' ' VAL . 0.2 OUTLIER -86.34 -19.74 29.34 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 0.0 110.312 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.3 m -77.04 -45.64 26.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.237 -0.914 . . . . 0.0 110.286 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -55.05 -57.35 12.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.304 -0.872 . . . . 0.0 110.121 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.03 -54.03 41.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 110.238 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.867 . . . . 0.0 110.244 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.26 -40.03 73.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.145 -0.972 . . . . 0.0 109.787 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.55 -53.65 39.91 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.624 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -48.49 -48.72 37.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.426 -1.044 . . . . 0.0 110.209 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 51.8 m -54.5 -32.5 58.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.474 -0.766 . . . . 0.0 110.221 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.19 -24.62 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.229 -0.919 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.48 ' OE2' ' CE1' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -88.65 -58.55 2.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.743 HG11 HD11 ' B' ' 11' ' ' LEU . 50.4 t -50.59 -41.12 20.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.735 -0.603 . . . . 0.0 110.364 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.2 -34.76 59.29 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.133 -0.98 . . . . 0.0 110.186 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.34 -49.45 14.93 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 110.324 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.09 -37.06 58.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.211 -0.93 . . . . 0.0 110.351 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.431 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 2.1 mt-30 53.21 53.95 12.18 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.237 -0.914 . . . . 0.0 110.285 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 43.5 Cg_endo -70.2 157.13 60.48 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.672 1.354 . . . . 0.0 110.48 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.0 -32.91 10.44 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.653 1.344 . . . . 0.0 110.411 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -120.14 122.75 41.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.229 -0.919 . . . . 0.0 110.281 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 tp -85.69 -36.83 20.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.21 -0.931 . . . . 0.0 110.114 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.459 HG12 ' HD3' ' B' ' 42' ' ' ARG . 45.8 t -51.47 -57.78 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.21 -0.931 . . . . 0.0 109.903 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -62.36 -37.38 85.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.643 -0.661 . . . . 0.0 110.087 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -65.39 -43.17 91.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.274 -0.891 . . . . 0.0 109.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.624 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -57.59 -37.93 74.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.404 -0.81 . . . . 0.0 110.062 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.526 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.2 t -69.71 -50.34 50.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 O-C-N 121.21 -0.931 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.76 -26.09 65.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.505 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.48 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 12.4 t80 -75.82 -68.69 0.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.125 -0.984 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 41' ' ' LEU . 45.3 m-85 -57.81 -47.97 81.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 110.625 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.482 ' OG1' HG13 ' B' ' 35' ' ' VAL . 64.6 m -51.27 -45.52 62.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.12 -0.987 . . . . 0.0 110.023 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -74.0 -26.49 60.47 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.299 -0.875 . . . . 0.0 109.628 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.442 ' HB2' ' HA ' ' A' ' 38' ' ' PHE . 1.3 tp -53.31 -36.55 61.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.932 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -42.15 92.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.319 -0.863 . . . . 0.0 110.113 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -85.31 -16.33 40.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.293 -0.879 . . . . 0.0 110.452 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.87 -67.91 0.25 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.08 -1.012 . . . . 0.0 110.091 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.95 -45.71 31.49 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.557 -0.714 . . . . 0.0 110.835 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.379 -179.808 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.294 0.569 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.0 mtm -110.65 105.44 14.34 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 110.119 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.98 100.53 2.3 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -143.89 152.11 40.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -1.184 . . . . 0.0 110.254 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.41 HG13 ' N ' ' B' ' 6' ' ' GLN . 1.4 tp -120.34 150.05 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.295 -0.878 . . . . 0.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' GLN . . . . . 0.41 ' N ' HG13 ' B' ' 5' ' ' ILE . 0.0 OUTLIER -172.6 91.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.276 -0.89 . . . . 0.0 110.391 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.63 HD12 ' N ' ' B' ' 7' ' ' ILE . 1.8 mp -89.35 110.15 36.65 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.277 -0.89 . . . . 0.0 109.57 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.48 157.33 56.56 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.565 1.297 . . . . 0.0 110.782 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -75.18 164.24 33.4 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.8 1.421 . . . . 0.0 110.508 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.2 -23.85 32.12 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.743 HD11 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -86.36 -19.62 29.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -1.136 . . . . 0.0 110.308 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 66.5 m -77.14 -45.66 26.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.239 -0.913 . . . . 0.0 110.269 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -54.98 -57.41 11.79 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.147 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.07 -53.98 42.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.333 -0.855 . . . . 0.0 110.245 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.35 -40.67 74.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -39.76 72.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.116 -0.99 . . . . 0.0 109.922 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.91 -53.47 41.91 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 108.807 -1.717 . . . . 0.0 108.807 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.631 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.5 t80 -48.7 -48.46 40.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.429 -1.042 . . . . 0.0 110.263 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.2 m -54.58 -32.43 58.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.469 -0.769 . . . . 0.0 110.185 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 96.2 t -81.25 -24.85 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 110.54 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.471 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.8 OUTLIER -88.44 -58.47 2.54 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.181 -0.949 . . . . 0.0 109.296 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.759 HG11 HD11 ' A' ' 11' ' ' LEU . 49.8 t -50.67 -40.96 20.11 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.765 -0.584 . . . . 0.0 110.414 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.3 -34.9 59.05 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.175 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.29 -49.35 15.2 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.141 -0.975 . . . . 0.0 110.339 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -76.23 -36.96 58.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.425 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 2.1 mt-30 53.15 53.97 12.29 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.352 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.7 Cg_endo -70.22 157.04 60.75 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.735 1.387 . . . . 0.0 110.503 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.76 -33.1 10.71 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.729 1.384 . . . . 0.0 110.498 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -120.08 123.03 42.39 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.18 -0.95 . . . . 0.0 110.365 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -85.81 -37.12 19.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.074 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.426 HG23 ' H ' ' B' ' 31' ' ' VAL . 46.0 t -51.04 -57.93 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.261 -0.9 . . . . 0.0 110.004 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -62.31 -37.43 85.53 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.527 -0.733 . . . . 0.0 110.17 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.17 -43.45 91.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.854 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.631 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.38 -38.15 73.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.306 -0.871 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.482 HG13 ' OG1' ' A' ' 39' ' ' THR . 99.9 t -69.54 -50.18 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 O-C-N 121.271 -0.893 . . . . 0.0 110.183 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.92 -26.12 65.68 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.298 -0.876 . . . . 0.0 110.512 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.471 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 12.2 t80 -75.91 -68.66 0.55 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.431 ' HA ' ' HB2' ' B' ' 41' ' ' LEU . 45.7 m-85 -57.81 -47.71 81.83 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.909 . . . . 0.0 110.534 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.526 ' OG1' HG13 ' A' ' 35' ' ' VAL . 68.9 m -51.47 -45.64 62.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.022 -1.049 . . . . 0.0 109.963 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -73.74 -26.78 60.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 109.688 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.431 ' HB2' ' HA ' ' B' ' 38' ' ' PHE . 1.3 tp -53.29 -36.55 61.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 109.91 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.459 ' HD3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -59.68 -42.48 93.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 110.036 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -84.89 -16.42 41.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.401 -0.812 . . . . 0.0 110.529 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.88 -67.59 0.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.146 -0.971 . . . . 0.0 110.295 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.95 -45.95 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.532 -0.73 . . . . 0.0 110.695 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 37.3 ttm-85 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.409 -179.874 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.0 m170 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.24 0.543 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 14.9 mmt -116.01 136.93 52.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.34 -0.85 . . . . 0.0 110.164 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -124.49 -170.58 13.23 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -129.73 32.85 4.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.181 -1.188 . . . . 0.0 110.135 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 48.0 mm -106.36 126.91 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.265 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -118.08 108.68 15.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.254 -0.904 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.45 115.06 52.33 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.142 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.21 137.43 28.66 Favored 'Trans proline' 0 C--N 1.313 -1.29 0 O-C-N 123.451 1.237 . . . . 0.0 110.406 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.25 151.11 38.04 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.573 1.302 . . . . 0.0 110.517 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.86 -27.71 8.52 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -26.08 30.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.224 -1.163 . . . . 0.0 110.303 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -53.47 -56.4 17.27 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.219 -0.926 . . . . 0.0 110.323 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.46 -50.14 63.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.401 -0.812 . . . . 0.0 110.408 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mp -52.83 -53.49 47.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.342 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 15' ' ' LEU . 4.6 mm? -65.37 -51.89 57.39 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 110.434 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.5 -33.05 43.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.062 -1.024 . . . . 0.0 109.897 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.412 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -59.23 -55.85 28.48 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 108.913 -1.675 . . . . 0.0 108.913 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.458 ' CE2' HD11 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -48.2 -44.78 33.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.407 -1.055 . . . . 0.0 110.391 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -55.63 -37.32 68.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.416 -0.802 . . . . 0.0 110.204 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.6 t -80.56 -25.64 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.671 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -85.67 -58.48 2.64 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.001 -1.062 . . . . 0.0 109.083 179.958 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 22' ' ' VAL . 38.9 t -52.03 -34.09 17.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.757 -0.589 . . . . 0.0 110.179 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.5 -33.9 54.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.07 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.54 -66.28 0.91 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.263 -0.898 . . . . 0.0 110.12 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.71 -40.89 66.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.068 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.49 56.61 13.75 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.307 -0.871 . . . . 0.0 110.364 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.51 151.32 58.85 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.66 1.347 . . . . 0.0 110.295 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.78 -28.39 20.43 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.701 1.369 . . . . 0.0 110.26 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.65 120.05 30.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.315 -0.866 . . . . 0.0 110.086 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.458 HD11 ' CE2' ' A' ' 18' ' ' TYR . 9.4 tp -82.88 -36.63 25.2 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 110.287 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 31' ' ' VAL . 44.8 t -51.02 -63.58 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.186 -0.946 . . . . 0.0 110.112 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.48 -35.76 72.69 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.455 -0.778 . . . . 0.0 110.103 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -66.58 -43.18 85.61 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 109.909 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.595 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -59.77 -35.29 74.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.389 -0.819 . . . . 0.0 110.275 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.483 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.4 t -74.24 -45.56 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 121.224 -0.923 . . . . 0.0 110.341 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.47 -20.64 66.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.25 -0.906 . . . . 0.0 110.373 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.51 -71.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.19 -0.944 . . . . 0.0 110.353 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.563 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 42.8 m-85 -56.48 -47.21 79.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.203 -0.936 . . . . 0.0 110.447 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.471 ' OG1' HG13 ' B' ' 35' ' ' VAL . 86.3 m -51.82 -42.85 62.82 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -75.15 -23.45 57.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.194 -0.941 . . . . 0.0 110.03 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -32.73 74.39 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.291 -0.88 . . . . 0.0 110.033 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -29.4 34.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.304 -0.872 . . . . 0.0 110.017 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.4 -23.24 40.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.418 -0.802 . . . . 0.0 110.1 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.28 -75.73 0.14 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.383 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 48.81 -153.65 0.1 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.607 -0.683 . . . . 0.0 110.624 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.237 -179.951 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 38.0 m170 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.16 0.505 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 15.0 mmt -115.98 136.86 52.64 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.0 110.211 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -124.29 -170.49 13.26 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -129.89 32.81 4.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.298 -1.119 . . . . 0.0 110.144 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 47.9 mm -106.41 126.77 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.341 -0.85 . . . . 0.0 110.295 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -117.87 108.84 15.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 110.273 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.57 114.95 52.14 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.073 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.09 137.42 28.94 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 123.436 1.229 . . . . 0.0 110.44 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -75.24 150.99 37.93 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.616 1.324 . . . . 0.0 110.454 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.01 -27.81 8.4 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -26.01 31.06 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.281 -1.129 . . . . 0.0 110.263 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 38.9 m -53.64 -56.25 18.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.278 -0.889 . . . . 0.0 110.309 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.58 -50.19 63.48 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.361 -0.837 . . . . 0.0 110.365 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.75 -53.57 46.14 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.388 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.449 HD22 ' N ' ' B' ' 15' ' ' LEU . 4.6 mm? -65.27 -51.9 57.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.216 -0.928 . . . . 0.0 110.404 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.58 -33.09 44.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.085 -1.01 . . . . 0.0 109.905 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -59.15 -55.87 28.38 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 108.929 -1.669 . . . . 0.0 108.929 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.46 ' CE2' HD11 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -48.23 -44.57 33.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.37 -1.077 . . . . 0.0 110.416 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.2 m -55.74 -37.41 68.44 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 110.264 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 86.3 t -80.4 -25.8 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.707 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.6 OUTLIER -85.58 -58.34 2.7 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.999 -1.063 . . . . 0.0 109.158 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 18' ' ' TYR . 38.5 t -52.25 -33.98 17.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.775 -0.578 . . . . 0.0 110.27 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.61 -33.77 53.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.166 -0.959 . . . . 0.0 109.976 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.59 -66.17 0.92 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -0.886 . . . . 0.0 110.105 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.79 -41.02 66.8 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 109.973 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.61 56.51 13.5 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.432 -0.793 . . . . 0.0 110.317 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.32 151.31 60.0 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.603 1.317 . . . . 0.0 110.307 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.65 -28.49 20.9 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.744 1.392 . . . . 0.0 110.327 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.6 120.3 31.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.369 -0.832 . . . . 0.0 110.052 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.46 HD11 ' CE2' ' B' ' 18' ' ' TYR . 9.1 tp -83.18 -36.36 24.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.247 -0.908 . . . . 0.0 110.216 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.424 HG23 ' H ' ' B' ' 31' ' ' VAL . 44.6 t -51.17 -63.44 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.246 -0.909 . . . . 0.0 110.052 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.62 -35.76 72.99 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.412 -0.805 . . . . 0.0 110.17 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -66.55 -43.28 85.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.196 -0.94 . . . . 0.0 109.829 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.563 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -59.66 -35.45 74.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 110.258 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.471 HG13 ' OG1' ' A' ' 39' ' ' THR . 91.0 t -74.24 -45.37 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.184 -0.948 . . . . 0.0 110.359 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.6 -20.56 66.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.57 -71.4 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.147 -0.971 . . . . 0.0 110.36 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.595 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 43.1 m-85 -56.32 -47.2 79.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.928 . . . . 0.0 110.435 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.483 ' OG1' HG13 ' A' ' 35' ' ' VAL . 86.8 m -51.78 -42.88 62.75 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.173 -0.954 . . . . 0.0 110.307 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -75.06 -23.64 58.09 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.266 -0.896 . . . . 0.0 110.064 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -32.88 74.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.225 -0.922 . . . . 0.0 110.069 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -29.44 32.91 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.205 -0.934 . . . . 0.0 109.996 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.4 -23.3 40.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.23 -75.8 0.14 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.849 . . . . 0.0 110.393 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 48.89 -153.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.619 -0.675 . . . . 0.0 110.615 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.208 179.999 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.242 0.544 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 ttp -140.94 26.73 2.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.2 -0.938 . . . . 0.0 110.132 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 98.01 94.77 1.96 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -163.41 130.7 3.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.257 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.541 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -111.01 64.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.258 -0.901 . . . . 0.0 110.177 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -104.99 175.4 5.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.6 mm -99.79 104.84 30.8 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.27 147.21 59.12 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.608 1.32 . . . . 0.0 110.591 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.22 171.08 16.72 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.717 1.377 . . . . 0.0 110.493 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.819 ' O ' HD12 ' A' ' 14' ' ' LEU . . . 98.22 -32.54 6.81 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.469 HD12 ' HG ' ' B' ' 30' ' ' LEU . 3.9 tp -87.82 -41.01 13.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.263 -1.14 . . . . 0.0 110.116 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.2 m -57.86 -57.61 12.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.976 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.08 21.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.404 -0.81 . . . . 0.0 109.984 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.819 HD12 ' O ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER -77.49 -49.58 14.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 109.997 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.39 -53.1 32.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.268 -0.895 . . . . 0.0 109.991 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.491 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -52.15 -43.16 63.92 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.818 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -55.15 -52.11 49.37 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.623 ' HE2' HD11 ' A' ' 30' ' ' LEU . 1.7 t80 -49.14 -49.34 42.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.405 -1.056 . . . . 0.0 110.17 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.0 m -55.7 -36.62 67.38 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.422 -0.799 . . . . 0.0 110.012 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 16' ' ' GLN . 47.6 t -75.04 -25.1 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.249 -0.907 . . . . 0.0 110.601 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.468 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -86.87 -57.99 2.77 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.178 -0.951 . . . . 0.0 109.254 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 18' ' ' TYR . 41.2 t -48.17 -30.99 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.753 -0.592 . . . . 0.0 110.484 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.55 HD21 HD11 ' B' ' 5' ' ' ILE . 2.8 tp -81.89 -37.71 26.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.189 -0.944 . . . . 0.0 110.128 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -77.62 -27.73 51.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.481 -179.87 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 3.5 pm0 -135.48 51.26 2.08 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.11 -0.994 . . . . 0.0 110.615 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -37.75 97.98 0.15 Allowed Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.964 -0.46 . . . . 0.0 111.458 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.6 Cg_endo -74.11 166.31 29.88 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.984 1.518 . . . . 0.0 110.552 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.59 -41.7 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.704 1.371 . . . . 0.0 110.273 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -122.04 116.38 24.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.896 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.623 HD11 ' HE2' ' A' ' 18' ' ' TYR . 0.8 OUTLIER -69.83 -45.1 68.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.225 -0.922 . . . . 0.0 109.686 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -51.79 -59.88 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.902 . . . . 0.0 109.881 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.46 -38.74 78.16 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.582 -0.699 . . . . 0.0 109.994 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -60.31 -46.97 88.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.933 . . . . 0.0 109.685 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.722 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -50.96 -38.44 50.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.425 -0.797 . . . . 0.0 110.389 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.486 HG13 ' OG1' ' B' ' 39' ' ' THR . 46.4 t -71.48 -55.28 14.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.214 -0.929 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.37 -38.34 68.72 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.262 -0.899 . . . . 0.0 110.589 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.468 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 14.6 t80 -68.07 -64.87 0.78 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.55 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.728 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 23.1 m-85 -60.23 -45.58 92.74 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.256 -0.902 . . . . 0.0 110.665 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.494 ' OG1' HG13 ' B' ' 35' ' ' VAL . 96.6 m -56.44 -42.45 78.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.0 110.399 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -73.9 -27.11 60.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.12 -0.987 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.19 -36.71 78.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.254 -0.903 . . . . 0.0 110.269 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.58 -40.28 74.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 110.313 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -80.54 -30.93 37.12 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.175 -0.953 . . . . 0.0 110.221 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.34 -71.41 0.07 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.257 -0.902 . . . . 0.0 110.358 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -50.33 -40.89 50.32 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.439 -0.788 . . . . 0.0 110.461 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.4 ttt180 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.287 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.289 0.566 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttp -141.05 26.9 2.0 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.249 -0.907 . . . . 0.0 110.178 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 97.84 94.7 1.95 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -163.3 130.71 3.52 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.287 -1.125 . . . . 0.0 110.255 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.55 HD11 HD21 ' A' ' 23' ' ' LEU . 1.0 OUTLIER -110.87 64.71 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.172 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -105.14 175.26 5.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 46.7 mm -99.69 104.95 31.12 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 109.976 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.33 147.29 58.89 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 123.556 1.293 . . . . 0.0 110.51 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.25 171.04 16.83 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.72 1.379 . . . . 0.0 110.539 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' GLY . . . . . 0.84 ' O ' HD12 ' B' ' 14' ' ' LEU . . . 98.23 -32.52 6.83 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.265 -1.534 . . . . 0.0 109.265 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.532 HD12 ' HG ' ' A' ' 30' ' ' LEU . 3.9 tp -87.84 -40.95 13.58 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.329 -1.101 . . . . 0.0 110.083 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 97.3 m -57.95 -57.54 12.34 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.168 -0.957 . . . . 0.0 109.941 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.15 21.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.365 -0.835 . . . . 0.0 109.911 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.84 HD12 ' O ' ' B' ' 10' ' ' GLY . 1.0 OUTLIER -77.34 -49.86 14.05 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.338 -0.851 . . . . 0.0 109.951 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.31 -52.96 34.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.495 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -52.27 -43.06 64.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.113 -0.992 . . . . 0.0 109.766 179.614 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.419 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -55.33 -51.84 51.64 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 108.826 -1.71 . . . . 0.0 108.826 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.621 ' HE2' HD11 ' B' ' 30' ' ' LEU . 1.7 t80 -49.33 -49.28 44.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.41 -1.053 . . . . 0.0 110.119 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 45.3 m -55.69 -36.71 67.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.452 -0.78 . . . . 0.0 110.049 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 16' ' ' GLN . 47.6 t -75.04 -25.04 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 110.518 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.46 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 1.0 OUTLIER -86.78 -58.2 2.69 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.039 -1.038 . . . . 0.0 109.338 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 18' ' ' TYR . 41.1 t -48.04 -30.89 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.77 -0.582 . . . . 0.0 110.559 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.509 HD21 HD11 ' A' ' 5' ' ' ILE . 2.9 tp -82.06 -37.6 26.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.97 . . . . 0.0 110.099 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -27.84 50.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.258 -0.901 . . . . 0.0 110.415 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' B' ' 27' ' ' PRO . 3.4 pm0 -135.44 51.45 2.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.135 -0.978 . . . . 0.0 110.52 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' B' ' 22' ' ' VAL . 3.2 mt-30 -37.94 98.05 0.15 Allowed Pre-proline 0 N--CA 1.5 2.035 0 O-C-N 122.009 -0.432 . . . . 0.0 111.464 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 47.8 Cg_endo -74.13 166.25 30.02 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.939 1.494 . . . . 0.0 110.58 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.48 -41.84 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.663 1.349 . . . . 0.0 110.263 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -121.93 116.49 24.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 110.268 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.621 HD11 ' HE2' ' B' ' 18' ' ' TYR . 0.8 OUTLIER -69.99 -45.06 68.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 109.655 179.789 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.0 t -51.72 -59.95 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 109.776 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.41 -38.95 78.43 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.668 -0.645 . . . . 0.0 109.914 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -60.21 -46.86 88.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.927 . . . . 0.0 109.699 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.728 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -50.95 -38.55 51.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.369 -0.832 . . . . 0.0 110.333 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.494 HG13 ' OG1' ' A' ' 39' ' ' THR . 46.4 t -71.39 -55.41 13.89 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.193 -0.942 . . . . 0.0 110.299 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -55.2 -38.4 68.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.46 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 14.6 t80 -68.14 -64.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.888 . . . . 0.0 110.501 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.722 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 23.4 m-85 -60.31 -45.38 93.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.733 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.486 ' OG1' HG13 ' A' ' 35' ' ' VAL . 96.9 m -56.66 -42.23 78.6 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.992 -1.068 . . . . 0.0 110.348 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -74.22 -26.88 60.51 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.29 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.26 -36.58 78.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.0 110.303 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.68 -40.28 75.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.236 -0.915 . . . . 0.0 110.409 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -80.51 -30.97 37.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.163 -0.961 . . . . 0.0 110.232 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.26 -71.42 0.07 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.334 -0.854 . . . . 0.0 110.347 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -50.19 -41.06 48.87 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.504 -0.748 . . . . 0.0 110.475 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 11.4 ttt180 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.214 -179.968 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.226 0.536 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.95 64.36 1.54 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.3 -0.875 . . . . 0.0 110.16 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.69 67.09 0.01 OUTLIER Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 10.2 m80 -143.75 -68.24 0.33 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.167 -1.196 . . . . 0.0 110.273 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.727 HG23 HD11 ' A' ' 7' ' ' ILE . 5.6 tp -113.42 154.55 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.846 . . . . 0.0 110.201 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.724 ' C ' HD12 ' A' ' 7' ' ' ILE . 10.3 mm100 -112.36 135.14 53.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.283 -0.886 . . . . 0.0 110.175 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.727 HD11 HG23 ' A' ' 5' ' ' ILE . 4.5 mp -129.45 57.32 29.63 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.198 -0.939 . . . . 0.0 109.95 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.77 151.04 57.07 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.766 1.403 . . . . 0.0 110.607 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.99 178.27 6.7 Favored 'Trans proline' 0 C--N 1.311 -1.395 0 O-C-N 123.749 1.394 . . . . 0.0 110.364 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.35 -25.96 12.88 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -51.16 5.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.174 -1.192 . . . . 0.0 110.27 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 m -52.79 -25.57 11.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.239 -0.913 . . . . 0.0 110.157 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.44 -58.96 3.32 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.165 -0.96 . . . . 0.0 110.239 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.68 -41.47 73.76 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.098 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.29 -44.81 95.05 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.328 -0.857 . . . . 0.0 110.087 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.05 -38.56 65.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.956 . . . . 0.0 109.698 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.53 -58.39 14.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.76 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.7 t80 -46.0 -40.24 10.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.511 -0.993 . . . . 0.0 110.685 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.2 m -62.7 -36.01 81.57 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.388 -0.82 . . . . 0.0 110.01 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 96.8 t -82.18 -21.84 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.26 -0.9 . . . . 0.0 110.745 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.454 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.24 8.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.028 -1.045 . . . . 0.0 109.332 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 18' ' ' TYR . 76.9 t -60.71 -34.5 59.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 121.7 -0.625 . . . . 0.0 110.408 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.36 -41.32 22.18 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.124 -0.985 . . . . 0.0 110.277 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -69.57 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.38 -36.87 64.35 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.253 -0.904 . . . . 0.0 110.173 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.11 59.6 14.47 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.23 -0.919 . . . . 0.0 110.157 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.98 149.8 59.73 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.715 1.376 . . . . 0.0 110.508 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.99 -29.98 17.25 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.723 1.38 . . . . 0.0 110.294 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -125.06 119.64 29.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -78.6 -35.68 45.39 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.246 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -51.05 -68.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.228 -0.92 . . . . 0.0 110.108 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.99 -41.54 71.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.469 -0.77 . . . . 0.0 109.785 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -58.58 -51.81 68.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.534 179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.76 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -53.66 -44.62 69.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.439 -0.788 . . . . 0.0 110.022 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.629 HG13 ' OG1' ' B' ' 39' ' ' THR . 92.9 t -71.04 -29.74 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 O-C-N 121.315 -0.866 . . . . 0.0 110.07 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.23 -26.6 39.02 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.259 -0.901 . . . . 0.0 109.586 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.454 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 27.8 t80 -76.57 -68.12 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.206 -0.933 . . . . 0.0 110.427 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -52.94 -45.81 67.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.304 -0.872 . . . . 0.0 110.65 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.618 ' OG1' HG13 ' B' ' 35' ' ' VAL . 24.0 m -54.51 -40.89 69.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.983 -1.073 . . . . 0.0 109.889 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -28.75 68.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 mt -75.57 -24.65 56.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 110.337 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -47.91 50.11 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.225 -0.922 . . . . 0.0 109.695 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.41 -26.91 68.74 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.356 -0.84 . . . . 0.0 110.047 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.96 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.335 -0.853 . . . . 0.0 110.202 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.06 -64.08 0.89 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.538 -0.726 . . . . 0.0 110.696 -179.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.243 0.544 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.04 64.31 1.54 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.274 -0.891 . . . . 0.0 110.227 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.79 66.93 0.01 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -143.66 -68.17 0.34 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -1.171 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.72 HG23 HD11 ' B' ' 7' ' ' ILE . 5.5 tp -113.51 154.53 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.296 -0.878 . . . . 0.0 110.157 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 6' ' ' GLN . . . . . 0.722 ' C ' HD12 ' B' ' 7' ' ' ILE . 10.3 mm100 -112.22 134.96 53.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.217 -0.927 . . . . 0.0 110.258 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.722 HD12 ' C ' ' B' ' 6' ' ' GLN . 4.5 mp -129.27 57.39 29.92 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.331 -0.855 . . . . 0.0 110.086 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.83 151.04 56.67 Favored 'Trans proline' 0 C--N 1.31 -1.489 0 O-C-N 123.682 1.359 . . . . 0.0 110.683 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.96 178.25 6.7 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.706 1.372 . . . . 0.0 110.415 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.27 -25.85 13.16 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.58 -51.06 5.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.134 -1.215 . . . . 0.0 110.293 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 69.3 m -52.98 -25.57 12.48 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.224 -0.922 . . . . 0.0 110.205 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -69.33 -59.09 3.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 110.16 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.51 -41.56 73.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.14 -44.91 94.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.191 -0.943 . . . . 0.0 110.128 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -38.58 65.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -57.74 -58.23 15.66 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.93 -1.668 . . . . 0.0 108.93 179.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.771 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.7 t80 -45.92 -40.33 10.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.534 -0.98 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 80.1 m -62.72 -35.97 81.47 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.104 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 98.8 t -82.27 -21.72 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.749 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.464 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.39 8.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.082 -1.011 . . . . 0.0 109.213 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 18' ' ' TYR . 73.6 t -60.6 -34.55 58.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.762 -0.586 . . . . 0.0 110.452 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.26 -41.34 22.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.122 -0.986 . . . . 0.0 110.251 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -69.62 0.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.302 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.24 -36.75 63.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.304 -0.873 . . . . 0.0 110.269 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 51.94 59.77 14.47 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.267 -0.896 . . . . 0.0 110.174 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.02 149.76 59.43 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.682 1.359 . . . . 0.0 110.529 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -71.04 -29.98 17.06 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.655 1.345 . . . . 0.0 110.327 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -125.03 119.6 29.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.134 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -78.43 -35.9 46.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.191 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.5 t -50.88 -68.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.277 -0.89 . . . . 0.0 110.203 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.94 -41.61 71.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.394 -0.816 . . . . 0.0 109.711 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -58.54 -51.99 67.56 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.294 -0.879 . . . . 0.0 109.511 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.771 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -53.66 -44.5 69.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.363 -0.836 . . . . 0.0 110.027 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.618 HG13 ' OG1' ' A' ' 39' ' ' THR . 90.9 t -71.13 -29.73 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.269 -0.895 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.06 -26.6 39.59 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.241 -0.912 . . . . 0.0 109.546 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.464 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 27.8 t80 -76.67 -68.03 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.17 -0.956 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -53.03 -45.7 68.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.592 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.629 ' OG1' HG13 ' A' ' 35' ' ' VAL . 23.8 m -54.55 -41.11 69.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.022 -1.049 . . . . 0.0 109.753 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -28.83 68.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.188 -0.945 . . . . 0.0 109.974 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.1 mt -75.64 -24.65 56.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 110.341 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -47.78 51.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.169 -0.957 . . . . 0.0 109.684 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.52 -26.88 68.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.972 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.78 -63.21 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.317 -0.865 . . . . 0.0 110.138 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.12 -64.08 0.89 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.559 -0.713 . . . . 0.0 110.731 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.18 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.263 0.554 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -111.66 -47.81 3.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.122 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.11 117.03 0.31 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.6 t60 -151.45 90.79 1.6 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -1.151 . . . . 0.0 110.184 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.5 tp -118.04 141.31 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.218 -0.926 . . . . 0.0 110.244 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -127.09 64.47 1.31 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.256 -0.902 . . . . 0.0 110.072 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.637 HD12 ' C ' ' A' ' 7' ' ' ILE . 2.4 pp -133.93 151.69 77.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.28 -0.888 . . . . 0.0 110.242 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.54 125.5 10.69 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.685 1.361 . . . . 0.0 110.131 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -73.2 159.26 47.62 Favored 'Trans proline' 0 C--N 1.313 -1.335 0 O-C-N 123.468 1.246 . . . . 0.0 110.424 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.08 -32.91 5.96 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -38.49 91.02 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -1.158 . . . . 0.0 110.204 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -53.79 -43.18 69.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.347 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.86 -25.34 66.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.924 . . . . 0.0 110.367 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD21 ' HE1' ' A' ' 38' ' ' PHE . 2.6 tp -71.68 -53.07 14.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.4 mt -60.2 -44.49 95.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.08 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -38.21 63.42 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.173 -0.955 . . . . 0.0 109.878 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.29 -57.05 21.16 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.636 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.8 t80 -46.65 -40.57 13.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.524 -0.986 . . . . 0.0 110.575 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.7 m -62.3 -36.57 82.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.394 -0.816 . . . . 0.0 110.267 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.82 -23.37 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.338 -0.851 . . . . 0.0 110.713 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 1.3 mt-10 -87.43 -54.36 4.33 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.01 -1.056 . . . . 0.0 109.246 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.15 -33.79 25.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.281 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 mt -78.35 -36.36 46.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.133 -0.98 . . . . 0.0 110.158 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -55.85 4.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.219 -0.926 . . . . 0.0 110.193 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' A' ' 27' ' ' PRO . 1.0 OUTLIER -61.18 -44.13 97.79 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.294 -0.879 . . . . 0.0 110.203 -179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.63 58.13 14.83 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.296 -0.877 . . . . 0.0 110.312 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' A' ' 25' ' ' GLN . 45.5 Cg_endo -72.35 156.69 54.48 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.589 1.31 . . . . 0.0 110.364 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.45 -19.05 33.33 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.743 1.391 . . . . 0.0 110.509 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.13 119.36 15.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.256 -0.902 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -81.16 -36.25 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.136 -0.977 . . . . 0.0 110.017 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.68 -65.5 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -0.909 . . . . 0.0 109.765 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.24 -41.73 76.19 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.427 -0.795 . . . . 0.0 109.732 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -57.65 -49.23 77.17 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.344 -0.847 . . . . 0.0 109.657 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.657 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -51.93 -34.97 44.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.357 -0.839 . . . . 0.0 110.226 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.29 -53.42 17.23 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.347 -0.846 . . . . 0.0 110.427 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.23 -23.15 46.12 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.0 110.319 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -79.1 -68.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.266 -0.896 . . . . 0.0 110.377 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.655 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 13.1 m-85 -57.08 -45.72 83.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.237 -0.914 . . . . 0.0 110.39 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.403 ' OG1' HG13 ' B' ' 35' ' ' VAL . 83.5 m -53.57 -48.88 68.76 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.937 . . . . 0.0 110.442 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -35.56 80.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.148 -0.97 . . . . 0.0 110.257 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.3 -43.39 67.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.0 110.27 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 -44.44 62.66 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.182 -0.949 . . . . 0.0 110.452 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.52 -31.18 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.99 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -91.9 -70.02 0.71 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.296 -0.877 . . . . 0.0 110.161 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -52.14 135.6 31.4 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.567 -0.708 . . . . 0.0 110.455 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.141 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.207 0.527 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -111.78 -47.82 3.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.277 -0.889 . . . . 0.0 110.134 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.15 117.14 0.32 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -151.67 90.5 1.56 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -1.166 . . . . 0.0 110.199 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tp -117.74 141.43 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.249 -0.907 . . . . 0.0 110.221 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -127.24 64.5 1.32 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.897 . . . . 0.0 110.079 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.637 HD12 ' C ' ' B' ' 7' ' ' ILE . 2.4 pp -133.98 151.56 76.94 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.319 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.53 125.45 10.66 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.762 1.401 . . . . 0.0 110.128 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.03 159.32 48.08 Favored 'Trans proline' 0 C--N 1.312 -1.354 0 O-C-N 123.439 1.231 . . . . 0.0 110.419 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.93 -32.99 5.85 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.35 90.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.284 -1.127 . . . . 0.0 110.171 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.0 m -54.03 -43.04 69.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.396 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.82 -25.4 66.42 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.277 -0.889 . . . . 0.0 110.317 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.493 HD21 ' HE1' ' B' ' 38' ' ' PHE . 2.5 tp -71.72 -52.85 15.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.242 -0.911 . . . . 0.0 110.256 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.36 -44.27 95.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.905 . . . . 0.0 110.067 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -38.3 64.26 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.141 -0.974 . . . . 0.0 109.774 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.13 -57.18 20.4 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.642 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.8 t80 -46.6 -40.39 12.82 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.53 -0.982 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -62.6 -36.29 82.26 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.437 -0.789 . . . . 0.0 110.296 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.96 -23.39 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.759 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 1.3 mt-10 -87.58 -54.18 4.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.056 -1.028 . . . . 0.0 109.289 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.18 -33.49 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 O-C-N 121.786 -0.571 . . . . 0.0 110.294 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' B' ' 23' ' ' LEU . 9.3 mt -78.6 -36.46 44.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.135 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.11 -55.83 4.31 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' B' ' 27' ' ' PRO . 1.0 OUTLIER -61.26 -44.01 97.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.6 58.1 14.88 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.319 -0.863 . . . . 0.0 110.383 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' B' ' 25' ' ' GLN . 45.9 Cg_endo -72.42 156.62 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.586 1.309 . . . . 0.0 110.498 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.27 -19.15 34.03 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.709 1.373 . . . . 0.0 110.47 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.16 119.19 15.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.236 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.98 -36.23 31.03 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.022 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.402 HG23 ' H ' ' B' ' 31' ' ' VAL . 41.1 t -53.62 -65.67 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.289 -0.882 . . . . 0.0 109.789 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.06 -41.71 75.48 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.52 -0.737 . . . . 0.0 109.744 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.327 -0.858 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.655 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -52.18 -34.89 47.14 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.348 -0.845 . . . . 0.0 110.194 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.403 HG13 ' OG1' ' A' ' 39' ' ' THR . 61.5 t -74.29 -53.51 16.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.349 -0.844 . . . . 0.0 110.452 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -57.14 -23.24 45.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.428 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -79.06 -68.18 0.68 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.275 -0.891 . . . . 0.0 110.438 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.657 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 13.2 m-85 -57.2 -45.75 83.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.154 -0.966 . . . . 0.0 110.414 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -53.42 -49.22 67.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.255 -0.903 . . . . 0.0 110.436 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.05 -35.78 81.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.155 -0.965 . . . . 0.0 110.298 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.13 -43.42 66.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.5 -44.55 62.56 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.293 -0.879 . . . . 0.0 110.47 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.42 -31.37 65.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.29 -0.881 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -91.7 -69.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.357 -0.84 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -52.12 135.55 31.35 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.484 -0.76 . . . . 0.0 110.375 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.248 179.923 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.765 HD21 HG11 ' B' ' 22' ' ' VAL . 0.1 OUTLIER -68.67 -57.33 5.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.208 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.6 m -52.4 -28.58 20.36 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.242 -0.911 . . . . 0.0 110.262 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -72.04 -59.19 2.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.625 HD23 ' HE1' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -55.18 -39.44 69.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.923 . . . . 0.0 110.199 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.0 mt -62.91 -43.99 97.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.95 . . . . 0.0 109.957 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.36 -37.95 65.53 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.16 -0.963 . . . . 0.0 109.653 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.44 -55.24 30.69 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.58 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.6 t80 -48.14 -38.83 18.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.404 -1.057 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.85 -36.52 83.53 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.472 -0.768 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.9 -25.07 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.773 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.6 mt-10 -82.69 -57.15 3.45 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.7 HG11 HD21 ' B' ' 11' ' ' LEU . 22.6 t -55.53 -32.91 31.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.126 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.1 -34.53 63.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.261 -0.9 . . . . 0.0 110.233 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.49 -62.59 1.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.204 -0.935 . . . . 0.0 110.362 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.16 -43.12 63.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.216 -0.927 . . . . 0.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.42 62.41 11.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.287 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.23 161.62 45.2 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 O-C-N 123.734 1.386 . . . . 0.0 110.527 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.19 -34.12 10.52 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.638 1.336 . . . . 0.0 110.423 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -129.05 123.85 33.38 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.289 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 tp -77.7 -40.9 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 0.0 110.176 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.427 ' H ' HG23 ' A' ' 31' ' ' VAL . 47.1 t -50.74 -65.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.907 . . . . 0.0 110.019 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.21 -38.95 71.72 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.5 -0.75 . . . . 0.0 110.07 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -62.17 -46.44 88.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.209 -0.932 . . . . 0.0 109.878 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.626 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.33 -33.28 58.58 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 0.0 110.197 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.417 HG13 ' OG1' ' B' ' 39' ' ' THR . 85.7 t -74.96 -49.97 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.333 -0.855 . . . . 0.0 110.248 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.32 -41.03 96.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.236 -0.915 . . . . 0.0 110.332 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.467 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.2 t80 -61.5 -60.12 4.19 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.918 . . . . 0.0 110.3 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.64 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 12.5 m-85 -63.62 -47.78 79.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.431 ' OG1' HG13 ' B' ' 35' ' ' VAL . 54.6 m -52.98 -29.88 31.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.948 . . . . 0.0 109.939 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.13 -34.5 37.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.336 -0.852 . . . . 0.0 109.827 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -23.08 63.76 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.322 -0.861 . . . . 0.0 110.068 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -75.36 -26.4 58.5 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.221 -0.924 . . . . 0.0 109.732 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.31 -0.869 . . . . 0.0 110.484 179.79 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.7 HD21 HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -68.44 -57.45 5.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -1.167 . . . . 0.0 110.235 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.6 m -52.27 -28.6 19.47 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.206 -0.934 . . . . 0.0 110.315 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -71.94 -59.2 2.86 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.184 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.614 HD23 ' HE1' ' B' ' 38' ' ' PHE . 0.2 OUTLIER -55.27 -39.16 69.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.261 -0.9 . . . . 0.0 110.289 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.18 -43.96 96.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.239 -0.913 . . . . 0.0 109.997 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -37.88 65.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.216 -0.928 . . . . 0.0 109.65 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.408 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.31 -55.35 29.96 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.583 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.6 t80 -48.14 -38.82 18.85 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -1.048 . . . . 0.0 110.363 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -36.32 82.93 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.465 -0.772 . . . . 0.0 110.211 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 90.4 t -80.98 -25.24 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.789 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.7 mt-10 -82.53 -57.14 3.47 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.1 -1.0 . . . . 0.0 109.284 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.765 HG11 HD21 ' A' ' 11' ' ' LEU . 22.4 t -55.63 -32.75 31.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 O-C-N 121.708 -0.62 . . . . 0.0 110.101 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.3 -34.38 63.49 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.65 -62.41 1.4 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.25 -0.906 . . . . 0.0 110.346 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.27 -43.22 64.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.311 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.51 62.41 11.12 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.281 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.22 161.51 45.58 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.692 1.364 . . . . 0.0 110.538 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.0 -34.33 10.61 Favored 'Trans proline' 0 C--N 1.31 -1.471 0 O-C-N 123.723 1.38 . . . . 0.0 110.456 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -128.89 124.09 34.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.287 -0.883 . . . . 0.0 110.226 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 tp -77.8 -41.05 38.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 110.082 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.417 HG23 ' H ' ' B' ' 31' ' ' VAL . 46.6 t -50.52 -65.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.245 -0.909 . . . . 0.0 110.046 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.17 -38.99 71.67 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.487 -0.758 . . . . 0.0 110.041 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -62.07 -46.5 88.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.898 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.64 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -54.3 -33.44 58.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.437 -0.79 . . . . 0.0 110.217 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.431 HG13 ' OG1' ' A' ' 39' ' ' THR . 86.7 t -74.87 -49.84 27.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.55 -40.76 95.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.353 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 33.0 t80 -61.65 -60.22 4.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.198 -0.939 . . . . 0.0 110.282 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.626 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 12.5 m-85 -63.48 -47.61 81.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.343 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.417 ' OG1' HG13 ' A' ' 35' ' ' VAL . 52.9 m -53.13 -29.94 34.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.123 -0.986 . . . . 0.0 109.972 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.1 -34.49 37.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 109.87 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.11 -23.09 63.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.337 -0.852 . . . . 0.0 110.084 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -75.43 -26.47 58.37 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.281 -0.887 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.893 . . . . 0.0 110.499 179.754 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.94 -32.38 72.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -1.172 . . . . 0.0 110.188 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.8 m -69.72 -30.88 68.61 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.158 -0.964 . . . . 0.0 110.228 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -71.48 -54.54 10.26 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.269 -0.894 . . . . 0.0 110.208 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.855 HD21 ' CE1' ' A' ' 38' ' ' PHE . 1.0 OUTLIER -55.59 -53.56 54.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.261 -0.899 . . . . 0.0 110.241 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.852 HD11 HD11 ' B' ' 15' ' ' LEU . 1.2 mm? -53.55 -38.86 64.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.227 -0.921 . . . . 0.0 110.193 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -43.93 70.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.14 -0.975 . . . . 0.0 109.956 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -55.67 -55.69 27.5 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.474 ' CD2' HG21 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -49.24 -47.48 46.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.42 -1.047 . . . . 0.0 110.31 179.552 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 77.7 m -53.15 -36.18 60.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.393 -0.817 . . . . 0.0 110.316 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.26 -25.0 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.174 -0.954 . . . . 0.0 110.417 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.4 mt-10 -89.13 -60.15 2.03 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.21 -0.931 . . . . 0.0 109.2 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.474 HG21 ' CD2' ' A' ' 18' ' ' TYR . 25.4 t -53.59 -26.71 13.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.75 -0.594 . . . . 0.0 110.116 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.409 ' CB ' ' O ' ' A' ' 19' ' ' THR . 2.7 tp -85.08 -35.69 21.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.295 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.27 -56.25 3.34 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.362 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.39 -41.94 81.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.158 -0.964 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 52.04 59.07 15.19 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.245 -0.909 . . . . 0.0 110.161 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.26 156.77 58.53 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.675 1.355 . . . . 0.0 110.573 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.45 -27.48 19.05 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.764 1.402 . . . . 0.0 110.453 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.19 119.93 21.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.41 -32.63 28.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.142 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.504 HG12 ' HD3' ' B' ' 42' ' ' ARG . 39.8 t -53.14 -64.67 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.251 -0.905 . . . . 0.0 109.829 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.91 77.81 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.527 -0.733 . . . . 0.0 109.958 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.55 -48.38 81.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.931 . . . . 0.0 109.521 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.518 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -55.4 -35.06 64.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.873 . . . . 0.0 109.585 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.432 ' CG1' ' OG1' ' B' ' 39' ' ' THR . 55.3 t -81.85 -44.37 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.424 -0.797 . . . . 0.0 109.723 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -26.76 66.96 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.222 -0.924 . . . . 0.0 109.855 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.442 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 38.3 t80 -78.88 -68.02 0.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 110.296 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.855 ' CE1' HD21 ' A' ' 14' ' ' LEU . 17.0 m-85 -52.21 -50.97 60.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.206 -0.934 . . . . 0.0 110.49 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.423 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 90.4 m -50.68 -52.92 35.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.36 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -63.43 -24.07 67.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.45 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.1 tt -65.05 -29.35 70.23 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 109.997 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.44 ' HD3' HG12 ' B' ' 31' ' ' VAL . 0.1 OUTLIER -60.22 -58.14 9.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.332 -0.855 . . . . 0.0 110.174 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.324 -0.86 . . . . 0.0 110.35 -179.915 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.5 tp -67.94 -32.46 72.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -1.149 . . . . 0.0 110.144 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 86.0 m -69.8 -30.68 68.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.304 -0.872 . . . . 0.0 110.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -71.61 -54.4 10.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.848 HD21 ' CE1' ' B' ' 38' ' ' PHE . 1.0 OUTLIER -55.77 -53.51 55.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.852 HD11 HD11 ' A' ' 15' ' ' LEU . 1.2 mm? -53.5 -38.96 64.2 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.32 -0.863 . . . . 0.0 110.208 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -44.17 70.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.283 -0.886 . . . . 0.0 109.946 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.41 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -55.37 -55.96 25.83 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.488 ' CD2' HG21 ' B' ' 22' ' ' VAL . 0.9 OUTLIER -49.0 -47.49 44.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.373 -1.075 . . . . 0.0 110.401 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.412 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 76.1 m -53.22 -36.14 60.7 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.423 -0.798 . . . . 0.0 110.323 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -78.19 -25.2 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.246 -0.909 . . . . 0.0 110.4 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.455 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.4 mt-10 -88.91 -60.14 2.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.236 -0.915 . . . . 0.0 109.257 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.488 HG21 ' CD2' ' B' ' 18' ' ' TYR . 25.0 t -53.51 -26.78 13.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.676 -0.64 . . . . 0.0 110.149 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.412 ' CB ' ' O ' ' B' ' 19' ' ' THR . 2.7 tp -85.05 -35.73 21.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 -56.32 3.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.893 . . . . 0.0 110.335 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.26 -41.88 80.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.135 -0.978 . . . . 0.0 110.49 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 51.92 59.17 15.22 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.192 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 156.89 57.87 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 O-C-N 123.755 1.397 . . . . 0.0 110.535 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.54 -27.48 18.75 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.676 1.356 . . . . 0.0 110.411 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.2 119.9 21.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.37 -32.84 29.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.886 . . . . 0.0 110.16 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.44 HG12 ' HD3' ' A' ' 42' ' ' ARG . 39.8 t -52.9 -64.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.264 -0.897 . . . . 0.0 109.865 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.94 77.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.558 -0.714 . . . . 0.0 109.976 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -61.44 -48.52 80.8 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.19 -0.944 . . . . 0.0 109.54 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.508 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -55.32 -35.28 64.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.375 -0.828 . . . . 0.0 109.573 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.423 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 57.1 t -81.66 -44.17 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 O-C-N 121.477 -0.764 . . . . 0.0 109.783 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.27 -26.65 66.67 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.455 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 38.4 t80 -78.98 -67.9 0.71 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.146 -0.971 . . . . 0.0 110.283 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.848 ' CE1' HD21 ' B' ' 14' ' ' LEU . 16.9 m-85 -52.22 -51.01 60.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.239 -0.913 . . . . 0.0 110.426 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.432 ' OG1' ' CG1' ' A' ' 35' ' ' VAL . 84.8 m -50.69 -52.94 35.31 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.38 -24.2 67.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.342 -0.849 . . . . 0.0 109.955 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.435 ' O ' HD23 ' B' ' 41' ' ' LEU . 1.1 tt -64.91 -29.33 70.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.504 ' HD3' HG12 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -60.22 -58.25 9.3 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.328 -0.857 . . . . 0.0 110.127 179.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.912 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.342 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.3 tp -77.5 -38.57 48.67 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -1.152 . . . . 0.0 110.37 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.7 m -63.46 -37.93 89.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.205 -0.935 . . . . 0.0 110.383 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.04 -41.76 68.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 110.282 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.56 -44.13 71.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.225 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.687 HD21 ' HD2' ' B' ' 18' ' ' TYR . 91.8 mt -67.83 -51.58 46.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 0.0 110.173 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.42 -34.61 25.11 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.068 -1.02 . . . . 0.0 109.932 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.44 -58.74 12.81 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.673 ' HD2' HD21 ' B' ' 15' ' ' LEU . 1.3 t80 -47.54 -44.56 26.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.447 -1.031 . . . . 0.0 110.663 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 m -50.74 -55.72 15.36 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.048 -1.033 . . . . 0.0 108.906 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.79 -44.27 98.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -52.55 -69.05 0.12 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.426 0.632 . . . . 0.0 110.768 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -52.44 -22.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.389 -0.819 . . . . 0.0 110.519 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.88 -20.99 34.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 110.195 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.77 -56.53 2.26 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.215 -0.928 . . . . 0.0 110.163 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -57.09 -43.58 82.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.26 -0.9 . . . . 0.0 110.148 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.454 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 0.0 OUTLIER 52.57 52.79 11.43 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.372 -0.83 . . . . 0.0 110.162 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 45.1 Cg_endo -71.28 156.18 59.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.633 1.333 . . . . 0.0 110.395 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.33 -29.84 16.4 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.658 1.346 . . . . 0.0 110.167 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.64 119.59 29.45 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.46 -41.93 23.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 0.0 110.346 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.558 HG12 ' HG2' ' B' ' 42' ' ' ARG . 41.2 t -50.7 -59.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.234 -0.916 . . . . 0.0 110.047 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -62.01 -36.02 80.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.508 -0.745 . . . . 0.0 110.024 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.419 ' HD2' ' HH ' ' A' ' 18' ' ' TYR . 53.3 t80 -65.49 -44.11 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.287 -0.883 . . . . 0.0 109.706 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.425 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.12 -36.07 70.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.443 -0.786 . . . . 0.0 110.124 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.541 HG13 ' OG1' ' B' ' 39' ' ' THR . 98.1 t -78.06 -44.91 27.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.56 -30.29 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.386 -0.821 . . . . 0.0 110.55 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -76.71 -58.26 3.38 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.157 -0.964 . . . . 0.0 110.376 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.404 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 12.6 m-85 -65.57 -43.17 90.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.546 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.488 ' OG1' HG13 ' B' ' 35' ' ' VAL . 53.7 m -54.68 -44.83 73.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.081 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.91 -31.92 72.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.172 -0.955 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -28.19 68.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 109.975 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.425 ' HG2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -68.6 -30.32 69.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.293 -0.88 . . . . 0.0 110.072 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -77.48 -38.46 49.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.201 -1.176 . . . . 0.0 110.386 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 57.0 m -63.48 -38.1 89.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.11 -0.994 . . . . 0.0 110.331 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.84 -41.79 67.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.257 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.65 -43.99 71.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 110.29 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.673 HD21 ' HD2' ' A' ' 18' ' ' TYR . 92.1 mt -67.87 -51.36 49.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.68 -34.46 26.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.157 -0.964 . . . . 0.0 110.005 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' B' ' 21' ' ' GLU . . . -59.64 -58.5 13.95 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.687 ' HD2' HD21 ' A' ' 15' ' ' LEU . 1.3 t80 -47.76 -44.55 28.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -1.016 . . . . 0.0 110.602 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -50.6 -55.7 15.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.047 -1.033 . . . . 0.0 108.878 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.5 t -63.82 -44.38 98.15 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.0 OUTLIER -52.49 -69.01 0.12 Allowed 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.374 0.607 . . . . 0.0 110.734 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.8 t -52.52 -22.73 3.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 O-C-N 121.38 -0.825 . . . . 0.0 110.498 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.8 -21.47 34.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.109 -0.995 . . . . 0.0 110.059 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.28 -56.43 2.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.283 -0.886 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -57.27 -43.68 83.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.158 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.0 OUTLIER 52.84 52.6 10.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.378 -0.826 . . . . 0.0 110.163 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 44.3 Cg_endo -71.05 156.14 60.43 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.639 1.337 . . . . 0.0 110.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.38 -29.63 16.56 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.667 1.351 . . . . 0.0 110.094 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.76 119.43 28.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.365 -0.834 . . . . 0.0 110.109 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.5 -42.03 23.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.239 -0.913 . . . . 0.0 110.254 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.425 HG12 ' HG2' ' A' ' 42' ' ' ARG . 41.1 t -50.66 -59.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.931 . . . . 0.0 110.051 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -62.05 -35.98 80.25 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.59 -0.694 . . . . 0.0 109.971 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 53.2 t80 -65.52 -43.85 88.76 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.309 -0.87 . . . . 0.0 109.656 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.417 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.59 -36.07 71.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.372 -0.83 . . . . 0.0 110.097 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.488 HG13 ' OG1' ' A' ' 39' ' ' THR . 92.4 t -78.02 -44.68 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 O-C-N 121.202 -0.936 . . . . 0.0 110.154 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.69 -30.64 68.92 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.331 -0.856 . . . . 0.0 110.573 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.407 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 74.0 t80 -76.35 -58.32 3.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.129 -0.982 . . . . 0.0 110.367 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -65.58 -42.52 91.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.597 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.541 ' OG1' HG13 ' A' ' 35' ' ' VAL . 53.5 m -55.24 -44.72 75.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.003 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.96 -32.11 72.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.02 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -28.39 68.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.277 -0.89 . . . . 0.0 109.968 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.558 ' HG2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -68.63 -30.09 68.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.286 -0.884 . . . . 0.0 110.195 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.918 . . . . 0.0 110.086 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -73.76 -28.44 61.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.314 -1.109 . . . . 0.0 110.184 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.5 m -71.64 -43.67 65.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.079 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.9 -36.66 62.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -0.875 . . . . 0.0 110.435 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.83 -50.39 35.98 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.895 . . . . 0.0 110.404 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.68 -49.14 72.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.19 -0.944 . . . . 0.0 110.136 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.97 -34.71 60.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.145 -0.972 . . . . 0.0 109.772 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.96 -52.8 46.6 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 108.705 -1.758 . . . . 0.0 108.705 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.588 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -47.67 -37.9 13.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.492 -1.005 . . . . 0.0 110.149 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -65.77 -33.05 74.96 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.585 -0.697 . . . . 0.0 110.335 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.8 t -81.3 -27.28 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 110.687 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -80.79 -56.9 3.82 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.055 -1.028 . . . . 0.0 109.378 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 30' ' ' LEU . 25.8 t -56.7 -31.91 36.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.763 -0.585 . . . . 0.0 110.294 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -75.15 -30.76 60.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.236 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.03 -51.71 4.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.205 -0.934 . . . . 0.0 110.484 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.6 -34.49 67.43 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.224 -0.922 . . . . 0.0 109.961 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.97 71.3 1.53 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.267 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.83 169.74 20.48 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.652 1.343 . . . . 0.0 110.462 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.12 -37.98 7.59 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.734 1.386 . . . . 0.0 110.331 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 33' ' ' PHE . 2.6 t70 -145.37 148.14 33.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.264 -0.898 . . . . 0.0 110.087 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.574 HD21 HG11 ' A' ' 22' ' ' VAL . 1.2 mt -83.71 -41.05 18.12 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.244 -0.91 . . . . 0.0 110.176 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.427 ' O ' HG23 ' A' ' 35' ' ' VAL . 41.2 t -52.13 -63.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.216 -0.928 . . . . 0.0 109.848 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.62 -39.66 85.0 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.539 -0.725 . . . . 0.0 109.882 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.423 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 34.1 t80 -62.83 -51.36 67.35 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 109.783 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.588 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -55.28 -33.88 63.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.387 -0.821 . . . . 0.0 110.004 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.499 HG13 ' OG1' ' B' ' 39' ' ' THR . 68.9 t -75.4 -50.51 23.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.32 -0.862 . . . . 0.0 110.198 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.46 -28.8 70.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.211 -0.93 . . . . 0.0 110.485 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -77.76 -63.08 1.47 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.219 -0.925 . . . . 0.0 110.471 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -58.6 -43.66 89.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.23 -0.919 . . . . 0.0 110.506 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.489 ' OG1' HG13 ' B' ' 35' ' ' VAL . 65.3 m -57.76 -46.24 84.79 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.335 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.04 -21.62 61.51 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.389 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.489 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -77.29 -20.3 55.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.381 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -23.0 43.74 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.227 -0.92 . . . . 0.0 109.758 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.098 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -74.14 -28.39 61.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -1.135 . . . . 0.0 110.136 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.7 m -71.67 -43.69 65.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 110.125 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.83 -36.56 62.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.252 -0.905 . . . . 0.0 110.456 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tp -70.83 -50.44 35.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.175 -0.953 . . . . 0.0 110.336 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.71 -49.14 72.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.95 -34.94 61.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.066 -1.022 . . . . 0.0 109.633 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.67 -53.01 44.5 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.582 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.4 t80 -47.61 -37.96 13.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.459 -1.024 . . . . 0.0 110.097 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.3 m -65.75 -32.93 74.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.584 -0.698 . . . . 0.0 110.401 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 55.8 t -81.3 -27.46 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 110.739 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.57 -57.16 3.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.216 -0.927 . . . . 0.0 109.43 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.554 HG11 HD21 ' B' ' 30' ' ' LEU . 26.1 t -56.45 -31.84 34.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.76 -0.588 . . . . 0.0 110.305 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 47.7 tp -75.31 -30.57 60.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.221 -0.924 . . . . 0.0 110.334 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.18 -51.65 4.33 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 0.0 110.486 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.71 -34.64 67.25 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.27 -0.894 . . . . 0.0 109.797 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.21 71.15 1.56 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.283 -0.885 . . . . 0.0 110.304 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.79 169.82 20.23 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.591 1.311 . . . . 0.0 110.466 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.18 -37.78 7.71 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.691 1.364 . . . . 0.0 110.315 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -145.61 148.05 32.7 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 110.084 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.554 HD21 HG11 ' B' ' 22' ' ' VAL . 1.1 mt -83.59 -41.28 18.03 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.415 ' O ' HG23 ' B' ' 35' ' ' VAL . 41.0 t -51.88 -63.36 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.916 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.68 -39.63 85.15 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.531 -0.731 . . . . 0.0 109.893 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.424 ' CD2' ' CE1' ' B' ' 18' ' ' TYR . 34.2 t80 -62.84 -51.11 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.795 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.582 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -55.53 -33.89 64.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 109.959 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.489 HG13 ' OG1' ' A' ' 39' ' ' THR . 70.3 t -75.41 -50.42 24.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.252 -0.905 . . . . 0.0 110.124 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.6 -28.78 70.13 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.253 -0.904 . . . . 0.0 110.445 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -77.57 -63.37 1.39 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.224 -0.922 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -58.38 -43.83 88.63 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.503 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.499 ' OG1' HG13 ' A' ' 35' ' ' VAL . 64.5 m -57.55 -46.2 84.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 0.0 110.359 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.14 -21.54 61.44 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.201 -0.937 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.498 ' O ' HD23 ' B' ' 41' ' ' LEU . 0.9 OUTLIER -77.52 -20.11 54.75 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.348 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.48 -22.78 43.62 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.225 -0.922 . . . . 0.0 109.763 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.262 -0.899 . . . . 0.0 110.17 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.476 HD11 HG11 ' B' ' 22' ' ' VAL . 1.0 OUTLIER -63.78 -38.73 92.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.235 -1.156 . . . . 0.0 110.146 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 48.4 m -57.75 -56.38 22.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.55 -50.38 53.57 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.439 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.443 ' HA ' HD12 ' A' ' 14' ' ' LEU . 7.8 tp -54.54 -55.52 28.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.46 -51.78 67.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.92 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.64 -30.41 31.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.003 -1.06 . . . . 0.0 109.648 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -58.47 -56.81 23.2 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 179.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.437 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t80 -47.65 -38.17 14.33 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.485 -1.009 . . . . 0.0 110.338 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 1.1 m -64.63 -34.18 77.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.43 -0.793 . . . . 0.0 109.844 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.34 -27.09 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.364 -0.835 . . . . 0.0 110.358 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -82.84 -59.25 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.089 -1.007 . . . . 0.0 108.99 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.49 HG11 ' CD2' ' A' ' 30' ' ' LEU . 43.5 t -55.03 -32.01 26.37 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.827 -0.546 . . . . 0.0 110.522 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 19' ' ' THR . 0.9 OUTLIER -83.73 -22.47 31.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.81 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.74 -58.58 2.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.456 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.44 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -82.92 -22.22 33.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.19 -0.944 . . . . 0.0 110.571 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.8 77.42 0.44 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.106 -0.996 . . . . 0.0 110.004 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 22' ' ' VAL . 44.4 Cg_endo -70.52 153.78 65.18 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.672 1.354 . . . . 0.0 110.574 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.82 -28.14 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.701 1.369 . . . . 0.0 110.441 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.96 125.28 12.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.347 -0.845 . . . . 0.0 110.15 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.49 ' CD2' HG11 ' A' ' 22' ' ' VAL . 1.2 mp -76.82 -31.38 56.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.292 -0.88 . . . . 0.0 109.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.866 HG12 ' HG2' ' B' ' 42' ' ' ARG . 44.8 t -54.3 -61.17 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 109.859 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.24 -45.69 83.61 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.964 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 25' ' ' GLN . 49.4 t80 -58.15 -47.4 83.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 109.87 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.52 -34.98 52.25 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.373 -0.83 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' B' ' 39' ' ' THR . 94.0 t -80.85 -52.46 14.17 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 121.19 -0.944 . . . . 0.0 110.14 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.85 -40.31 66.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.314 -0.866 . . . . 0.0 110.554 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -70.38 -68.22 0.44 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.979 . . . . 0.0 110.347 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.4 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 6.3 m-85 -50.47 -42.42 54.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.549 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.457 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.4 m -58.7 -35.72 73.09 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.103 -0.998 . . . . 0.0 109.855 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.44 -42.22 87.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.292 -0.88 . . . . 0.0 109.952 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.424 ' HA ' HD23 ' A' ' 41' ' ' LEU . 20.1 mt -59.21 -35.55 73.81 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.287 -0.883 . . . . 0.0 109.982 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.708 ' HG2' HG12 ' B' ' 31' ' ' VAL . 3.7 mmm-85 -56.13 -38.42 70.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.43 -0.794 . . . . 0.0 110.066 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.313 -0.867 . . . . 0.0 110.546 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.44 HD11 HG11 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -63.84 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -1.134 . . . . 0.0 110.151 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 47.5 m -57.67 -56.7 18.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.299 -0.876 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.3 -50.56 50.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.336 -0.852 . . . . 0.0 110.418 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.44 ' HA ' HD12 ' B' ' 14' ' ' LEU . 7.8 tp -54.59 -55.35 30.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.878 . . . . 0.0 110.311 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.54 -51.81 67.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.269 -0.894 . . . . 0.0 110.264 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.61 -30.57 32.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.112 -0.992 . . . . 0.0 109.654 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -58.27 -56.77 23.4 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 108.806 -1.717 . . . . 0.0 108.806 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.437 ' O ' HG23 ' B' ' 22' ' ' VAL . 1.1 t80 -47.81 -38.04 14.97 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.365 -1.079 . . . . 0.0 110.322 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' B' ' 23' ' ' LEU . 1.0 OUTLIER -64.77 -33.88 77.03 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.389 -0.819 . . . . 0.0 109.838 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.63 -26.91 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.34 -0.85 . . . . 0.0 110.415 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.7 OUTLIER -83.0 -59.37 2.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.948 . . . . 0.0 108.897 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.49 HG11 ' CD2' ' B' ' 30' ' ' LEU . 43.8 t -54.91 -32.16 26.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.83 -0.543 . . . . 0.0 110.528 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' B' ' 19' ' ' THR . 0.9 OUTLIER -83.51 -22.58 32.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.089 -1.007 . . . . 0.0 110.363 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.61 -58.6 2.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.391 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.431 ' OE1' ' CZ ' ' B' ' 33' ' ' PHE . 0.0 OUTLIER -82.98 -22.29 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.59 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.89 77.44 0.44 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.117 -0.99 . . . . 0.0 109.971 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 22' ' ' VAL . 44.2 Cg_endo -70.66 153.83 64.54 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.717 1.377 . . . . 0.0 110.534 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.85 -28.16 20.34 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 O-C-N 123.838 1.441 . . . . 0.0 110.443 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.98 125.14 12.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.169 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.49 ' CD2' HG11 ' B' ' 22' ' ' VAL . 1.2 mp -76.68 -31.39 57.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.878 . . . . 0.0 110.025 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.708 HG12 ' HG2' ' A' ' 42' ' ' ARG . 43.9 t -54.22 -61.3 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.303 -0.873 . . . . 0.0 109.789 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -65.21 -45.45 84.66 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.431 ' CZ ' ' OE1' ' B' ' 25' ' ' GLN . 49.4 t80 -58.41 -47.41 84.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.849 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.38 -35.05 50.57 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.361 -0.837 . . . . 0.0 110.23 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.457 HG13 ' OG1' ' A' ' 39' ' ' THR . 94.8 t -80.79 -52.64 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.64 -40.41 65.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -70.23 -68.41 0.42 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.071 -1.018 . . . . 0.0 110.294 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -50.47 -42.31 54.21 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' A' ' 35' ' ' VAL . 54.9 m -58.61 -35.86 73.12 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.143 -0.973 . . . . 0.0 109.907 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -42.26 88.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 109.945 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' B' ' 41' ' ' LEU . 20.2 mt -59.26 -35.45 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.302 -0.874 . . . . 0.0 109.953 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.866 ' HG2' HG12 ' A' ' 31' ' ' VAL . 3.7 mmm-85 -56.14 -38.5 70.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.321 -0.862 . . . . 0.0 110.134 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.484 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -75.09 -19.34 60.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -1.168 . . . . 0.0 110.325 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.7 m -69.96 -54.85 11.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.216 -0.928 . . . . 0.0 110.341 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -54.22 -37.12 64.23 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.327 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 14' ' ' LEU . 16.5 mt -63.06 -59.35 4.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.197 -0.939 . . . . 0.0 110.289 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.31 -48.81 80.22 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.353 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.32 -38.64 63.38 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.188 -0.945 . . . . 0.0 109.92 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.83 -52.8 48.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.33 -47.74 36.7 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.388 -1.066 . . . . 0.0 110.094 179.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.8 -40.93 56.65 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.387 -0.821 . . . . 0.0 110.471 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -76.97 -25.29 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.219 -0.926 . . . . 0.0 110.822 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -86.3 -59.08 2.39 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.07 -1.019 . . . . 0.0 109.241 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.41 ' H ' HG23 ' A' ' 22' ' ' VAL . 44.1 t -52.31 -26.71 9.45 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.3 tp -85.41 -38.13 19.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.093 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -53.52 5.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.205 -0.935 . . . . 0.0 110.082 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -61.64 -41.38 97.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 110.104 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 50.03 56.24 17.45 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.337 -0.852 . . . . 0.0 110.375 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.39 155.81 59.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.623 1.328 . . . . 0.0 110.419 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.5 -21.53 25.88 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 O-C-N 123.706 1.372 . . . . 0.0 110.524 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.67 119.48 15.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.281 -0.887 . . . . 0.0 110.321 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.96 -30.23 35.21 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.337 -0.852 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.2 t -51.51 -66.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.187 -0.946 . . . . 0.0 110.063 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.404 ' OD1' ' NH1' ' B' ' 42' ' ' ARG . 1.1 t70 -55.39 -42.76 74.45 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.363 -0.835 . . . . 0.0 109.971 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -58.31 -50.25 74.3 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.826 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.55 64.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.352 -0.843 . . . . 0.0 110.366 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.552 HG13 ' OG1' ' B' ' 39' ' ' THR . 91.6 t -74.04 -46.12 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.179 -0.951 . . . . 0.0 110.26 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.44 -24.22 67.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -73.36 -68.13 0.52 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.233 -0.917 . . . . 0.0 110.391 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.427 ' HB3' HG23 ' B' ' 35' ' ' VAL . 29.9 m-85 -59.33 -50.78 72.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.944 . . . . 0.0 110.389 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.56 ' OG1' HG13 ' B' ' 35' ' ' VAL . 97.8 m -49.97 -33.77 18.81 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.12 -0.988 . . . . 0.0 110.235 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -75.39 -25.28 57.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -38.28 90.2 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' NH1' ' OD1' ' B' ' 32' ' ' ASP . 0.0 OUTLIER -50.54 -40.01 50.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 179.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 110.121 179.931 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.388 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -74.97 -19.69 59.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -1.144 . . . . 0.0 110.301 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 74.9 m -69.56 -54.87 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 110.37 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.29 -37.07 64.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.332 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 14' ' ' LEU . 16.6 mt -63.01 -59.57 4.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.291 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.2 -48.66 80.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 110.283 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -53.36 -38.88 63.71 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.019 -1.05 . . . . 0.0 109.916 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.42 -53.15 45.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 108.86 -1.696 . . . . 0.0 108.86 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.12 -47.68 34.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.405 -1.056 . . . . 0.0 110.146 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.9 -40.82 57.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.518 -0.739 . . . . 0.0 110.513 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -77.14 -25.2 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.185 -0.947 . . . . 0.0 110.676 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.6 OUTLIER -86.42 -58.86 2.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.105 -0.997 . . . . 0.0 109.265 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 44.4 t -52.51 -26.64 10.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 121.729 -0.607 . . . . 0.0 110.214 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -85.47 -38.17 18.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.26 -0.9 . . . . 0.0 110.056 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.82 -53.53 5.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.177 -0.952 . . . . 0.0 110.023 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -61.6 -41.63 97.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 109.991 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 50.27 56.19 17.29 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.367 -0.833 . . . . 0.0 110.346 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 155.9 58.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 O-C-N 123.713 1.375 . . . . 0.0 110.459 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.46 -21.51 26.01 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.721 1.379 . . . . 0.0 110.6 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.7 119.35 15.02 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.179 -0.951 . . . . 0.0 110.305 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.93 -30.15 35.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.147 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -51.58 -65.99 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . 0.406 ' OD1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 t70 -55.35 -42.94 74.53 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.444 -0.785 . . . . 0.0 109.941 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -58.13 -50.36 73.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.242 -0.911 . . . . 0.0 109.897 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.24 -40.29 64.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.396 -0.815 . . . . 0.0 110.426 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.56 HG13 ' OG1' ' A' ' 39' ' ' THR . 93.3 t -74.08 -46.23 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.35 -24.27 67.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.172 -0.955 . . . . 0.0 110.294 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -73.29 -67.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.427 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.42 ' HB3' HG23 ' A' ' 35' ' ' VAL . 29.2 m-85 -59.68 -50.46 73.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.267 -0.895 . . . . 0.0 110.443 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.552 ' OG1' HG13 ' A' ' 35' ' ' VAL . 98.8 m -50.15 -33.83 20.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.074 -1.016 . . . . 0.0 110.205 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -75.27 -25.27 57.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.219 -0.925 . . . . 0.0 109.79 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -38.01 89.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.327 -0.858 . . . . 0.0 109.803 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH1' ' OD1' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -50.88 -39.9 55.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.362 -0.836 . . . . 0.0 110.155 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 . . . . . 0 N--CA 1.49 1.536 0 O-C-N 121.35 -0.843 . . . . 0.0 110.234 179.839 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.788 ' O ' HD23 ' A' ' 11' ' ' LEU . 2.9 tt -73.36 -27.26 61.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.191 -1.182 . . . . 0.0 110.29 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 41.2 m -65.22 -47.29 77.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.238 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -57.63 -33.81 68.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 -58.78 4.27 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 73.4 mt -56.55 -41.58 77.11 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.213 -0.929 . . . . 0.0 109.774 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -41.06 59.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.185 -0.947 . . . . 0.0 109.779 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 21' ' ' GLU . . . -56.61 -61.35 7.58 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.652 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 2.2 t80 -48.64 -47.73 40.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.459 -1.024 . . . . 0.0 110.506 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.1 -54.41 25.24 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.092 -1.005 . . . . 0.0 108.879 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.29 -44.86 99.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -51.27 -65.07 0.62 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-O 121.478 0.656 . . . . 0.0 110.685 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 18' ' ' TYR . 21.1 t -54.95 -29.29 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.591 -0.693 . . . . 0.0 110.341 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -72.71 -25.57 61.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.087 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -104.49 -50.47 3.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.227 -0.921 . . . . 0.0 109.996 179.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -86.34 50.85 2.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.326 -0.859 . . . . 0.0 110.452 -179.893 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.35 96.09 0.11 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.826 -0.546 . . . . 0.0 111.121 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.414 ' CD ' ' O ' ' A' ' 25' ' ' GLN . 48.2 Cg_endo -89.92 153.42 4.93 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 124.004 1.529 . . . . 0.0 110.804 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.06 -27.93 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.694 1.365 . . . . 0.0 109.812 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.44 115.8 11.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.488 -0.758 . . . . 0.0 109.839 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.72 -38.26 83.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.261 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.8 t -53.6 -65.72 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.174 -0.954 . . . . 0.0 109.866 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -56.98 -34.73 68.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.359 -0.838 . . . . 0.0 109.964 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.471 ' HD2' ' HH ' ' A' ' 18' ' ' TYR . 64.9 t80 -66.75 -44.32 81.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 0.0 109.675 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.652 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -62.55 -30.56 71.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.314 -0.866 . . . . 0.0 109.958 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.402 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.8 t -76.55 -48.41 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.337 -0.852 . . . . 0.0 110.165 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.18 -26.3 64.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.477 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -78.25 -68.47 0.64 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.127 -0.983 . . . . 0.0 110.525 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -56.93 -45.3 82.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.237 -0.915 . . . . 0.0 110.528 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.42 ' OG1' HG13 ' B' ' 35' ' ' VAL . 99.7 m -53.55 -43.98 68.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.082 -1.011 . . . . 0.0 110.024 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -66.12 -32.08 73.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.323 -0.861 . . . . 0.0 110.116 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -64.9 -40.07 94.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.025 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -39.42 90.16 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.336 -0.852 . . . . 0.0 110.296 -179.947 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.788 ' O ' HD23 ' B' ' 11' ' ' LEU . 2.9 tt -73.34 -27.28 61.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.229 -1.16 . . . . 0.0 110.299 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 39.9 m -65.22 -47.38 77.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.281 -0.887 . . . . 0.0 110.267 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -57.55 -33.93 68.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.86 -59.04 3.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 110.08 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -56.28 -41.68 76.26 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 109.801 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -40.93 59.74 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.077 -1.014 . . . . 0.0 109.891 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' B' ' 21' ' ' GLU . . . -56.55 -61.47 7.44 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.649 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 2.2 t80 -48.63 -47.83 39.93 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.392 -1.064 . . . . 0.0 110.517 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.02 -54.5 24.02 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.147 -0.971 . . . . 0.0 108.886 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.19 -44.71 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.2 OUTLIER -51.43 -64.98 0.64 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.564 0.697 . . . . 0.0 110.707 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.494 HG23 ' O ' ' B' ' 18' ' ' TYR . 21.1 t -54.99 -29.39 21.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.424 -0.798 . . . . 0.0 110.296 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -25.52 61.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.161 -0.962 . . . . 0.0 110.089 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.414 ' N ' ' HD2' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -104.62 -50.55 3.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.957 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.415 ' O ' ' N ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER -86.28 50.75 2.05 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.37 -0.831 . . . . 0.0 110.468 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.25 95.98 0.1 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.83 -0.543 . . . . 0.0 111.14 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.415 ' N ' ' O ' ' B' ' 25' ' ' GLN . 48.3 Cg_endo -89.86 153.48 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 124.014 1.534 . . . . 0.0 110.803 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.04 -28.12 19.58 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.733 1.386 . . . . 0.0 109.88 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.21 115.85 12.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.433 -0.792 . . . . 0.0 109.778 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.66 -38.34 83.64 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.4 t -53.63 -65.6 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -0.959 . . . . 0.0 109.929 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.08 -34.58 68.45 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.507 -0.745 . . . . 0.0 109.983 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.457 ' HD2' ' HH ' ' B' ' 18' ' ' TYR . 65.5 t80 -66.98 -43.85 81.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.649 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -62.89 -30.54 71.61 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.32 -0.862 . . . . 0.0 109.948 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.42 HG13 ' OG1' ' A' ' 39' ' ' THR . 87.8 t -76.43 -48.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.368 -0.833 . . . . 0.0 110.178 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -59.11 -26.4 64.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 110.473 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -78.12 -68.17 0.66 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.588 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -57.29 -45.43 84.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.206 -0.933 . . . . 0.0 110.426 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.409 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 99.7 m -53.43 -43.85 68.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.099 -1.001 . . . . 0.0 110.079 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -66.23 -31.98 73.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.091 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.03 -39.86 94.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.251 -0.906 . . . . 0.0 110.038 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -39.51 90.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 110.151 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.265 -179.967 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.11 -52.98 19.43 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 110.407 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.1 m -60.76 -49.95 75.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.877 . . . . 0.0 110.401 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.67 -45.57 66.84 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.324 -0.86 . . . . 0.0 110.407 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 14' ' ' LEU . 2.1 mt -56.08 -53.56 55.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.168 -0.957 . . . . 0.0 110.341 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.49 HD21 ' HD2' ' B' ' 18' ' ' TYR . 66.7 mt -62.73 -47.82 81.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.21 -0.931 . . . . 0.0 110.08 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.58 -34.55 58.75 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.236 -0.915 . . . . 0.0 109.719 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.77 -55.28 30.85 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.435 ' HD2' HD21 ' B' ' 15' ' ' LEU . 1.6 t80 -47.39 -43.66 23.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.504 -0.998 . . . . 0.0 110.404 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.4 m -55.9 -36.12 67.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.431 -0.793 . . . . 0.0 110.265 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.7 t -82.41 -25.35 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 110.543 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.8 mt-10 -85.32 -54.12 4.8 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.13 -0.981 . . . . 0.0 108.886 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.9 t -53.75 -39.15 37.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 CA-C-O 121.219 0.533 . . . . 0.0 110.308 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.508 HD12 ' O ' ' A' ' 19' ' ' THR . 12.1 mt -70.99 -40.4 71.88 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -65.42 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.236 -0.915 . . . . 0.0 110.242 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.13 65.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.177 -0.952 . . . . 0.0 110.081 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.96 58.58 16.81 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.318 -0.864 . . . . 0.0 110.566 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.54 146.89 50.63 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.627 1.33 . . . . 0.0 110.303 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.66 -30.77 17.6 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.63 1.332 . . . . 0.0 110.536 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -133.6 121.21 21.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 110.241 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.5 -25.04 41.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.065 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.679 HG12 ' HD2' ' B' ' 42' ' ' ARG . 41.0 t -54.34 -53.71 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.211 -0.931 . . . . 0.0 109.793 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.38 -47.44 60.9 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.584 -0.697 . . . . 0.0 109.934 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -58.13 -50.51 73.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.224 -0.922 . . . . 0.0 109.577 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.464 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -53.78 -37.35 63.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.306 -0.871 . . . . 0.0 109.921 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.507 HG13 ' OG1' ' B' ' 39' ' ' THR . 68.8 t -79.31 -34.89 16.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.34 -0.85 . . . . 0.0 109.915 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.76 -22.75 49.76 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -79.76 -64.01 1.28 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.176 -0.952 . . . . 0.0 110.623 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.482 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 15.4 m-85 -59.43 -48.07 83.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.198 -0.939 . . . . 0.0 110.533 -179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.517 ' OG1' HG13 ' B' ' 35' ' ' VAL . 62.3 m -52.48 -50.57 62.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.041 -1.037 . . . . 0.0 110.052 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -58.79 -26.7 64.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.157 -0.965 . . . . 0.0 109.832 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -61.63 -40.9 96.5 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.4 -0.813 . . . . 0.0 110.12 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.646 ' HD2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -52.55 -63.06 1.26 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.907 . . . . 0.0 110.241 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 tp -70.16 -52.81 20.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.093 -1.24 . . . . 0.0 110.422 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 85.7 m -60.86 -49.83 75.88 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.167 -0.958 . . . . 0.0 110.308 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.79 -45.54 67.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.0 110.37 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 14' ' ' LEU . 2.1 mt -56.1 -53.73 53.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.294 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.435 HD21 ' HD2' ' A' ' 18' ' ' TYR . 66.4 mt -62.63 -47.89 81.77 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.912 . . . . 0.0 110.022 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.55 -34.63 58.92 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.15 -0.969 . . . . 0.0 109.659 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.69 -55.29 30.74 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.85 -1.7 . . . . 0.0 108.85 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.49 ' HD2' HD21 ' A' ' 15' ' ' LEU . 1.6 t80 -47.43 -43.56 23.95 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.375 -1.074 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.512 ' O ' HD12 ' B' ' 23' ' ' LEU . 2.4 m -56.09 -35.92 67.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.531 -0.731 . . . . 0.0 110.254 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.46 -25.53 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.26 -0.9 . . . . 0.0 110.476 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.421 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 1.8 mt-10 -85.22 -54.06 4.85 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 108.877 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 95.6 t -53.82 -39.04 37.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.859 -0.526 . . . . 0.0 110.249 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.512 HD12 ' O ' ' B' ' 19' ' ' THR . 12.2 mt -71.1 -40.53 71.45 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.235 -0.915 . . . . 0.0 110.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.04 -65.48 0.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 110.266 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.26 -31.09 65.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.203 -0.936 . . . . 0.0 110.015 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.93 58.56 16.83 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.525 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.37 146.96 51.73 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.691 1.364 . . . . 0.0 110.339 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.71 -31.01 17.04 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.685 1.361 . . . . 0.0 110.52 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -133.43 121.34 22.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.274 -0.891 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.52 -25.16 41.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 110.067 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.646 HG12 ' HD2' ' A' ' 42' ' ' ARG . 41.6 t -54.22 -53.73 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.768 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.42 -47.37 61.05 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.598 -0.689 . . . . 0.0 109.952 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -58.2 -50.33 73.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 109.619 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.482 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -53.87 -37.51 63.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.345 -0.847 . . . . 0.0 109.881 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.517 HG13 ' OG1' ' A' ' 39' ' ' THR . 72.2 t -79.13 -34.78 16.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 O-C-N 121.341 -0.85 . . . . 0.0 110.019 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.94 -22.64 49.23 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.314 -0.866 . . . . 0.0 109.669 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -79.75 -64.24 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.218 -0.926 . . . . 0.0 110.586 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.464 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 15.2 m-85 -59.21 -47.98 83.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.184 -0.947 . . . . 0.0 110.683 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.507 ' OG1' HG13 ' A' ' 35' ' ' VAL . 61.0 m -52.76 -50.37 63.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.956 -1.09 . . . . 0.0 110.051 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -59.0 -26.65 64.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.857 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tp -61.67 -40.87 96.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 110.04 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.679 ' HD2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -52.45 -63.21 1.22 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.283 -0.886 . . . . 0.0 110.193 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.16 -29.16 70.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 110.214 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.9 m -56.77 -45.73 81.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.9 . . . . 0.0 110.123 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 -36.92 79.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -0.846 . . . . 0.0 110.366 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.33 -47.9 53.72 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.2 -0.938 . . . . 0.0 110.232 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.41 ' HA ' HD13 ' A' ' 15' ' ' LEU . 0.7 OUTLIER -65.36 -58.2 6.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.075 -1.015 . . . . 0.0 110.102 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.4 -24.69 5.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.155 -0.966 . . . . 0.0 109.903 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -65.94 -57.41 10.89 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.6 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t80 -48.54 -35.8 14.07 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.384 -1.068 . . . . 0.0 110.312 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.01 -39.17 93.96 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.42 -0.8 . . . . 0.0 110.065 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.423 ' O ' ' CB ' ' A' ' 24' ' ' ARG . 92.2 t -80.88 -21.52 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 110.798 -179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.4 OUTLIER -86.95 -55.05 4.01 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.065 -1.022 . . . . 0.0 109.333 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 18' ' ' TYR . 29.0 t -56.85 -31.18 35.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.722 -0.611 . . . . 0.0 110.389 -179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.454 ' HA ' HD23 ' A' ' 23' ' ' LEU . 32.4 mt -87.43 -42.0 13.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.218 -0.926 . . . . 0.0 110.34 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -71.9 -53.27 13.69 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.143 -0.973 . . . . 0.0 110.262 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.31 -35.35 63.66 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.191 -0.943 . . . . 0.0 109.855 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.3 64.07 8.97 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.476 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.39 151.29 65.38 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.741 1.39 . . . . 0.0 110.527 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.36 -22.52 25.05 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.733 1.386 . . . . 0.0 110.272 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.73 116.31 14.75 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.261 -0.9 . . . . 0.0 110.13 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.538 HD11 ' CE2' ' A' ' 18' ' ' TYR . 7.5 tp -80.53 -34.2 35.73 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 110.307 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 31' ' ' VAL . 48.4 t -51.67 -66.21 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.208 -0.932 . . . . 0.0 110.142 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.15 -40.5 67.49 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.428 -0.795 . . . . 0.0 109.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.9 -54.98 38.44 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.36 -0.838 . . . . 0.0 109.763 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.519 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -53.0 -38.55 62.4 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.575 HG13 ' OG1' ' B' ' 39' ' ' THR . 81.6 t -77.37 -27.09 15.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.293 -0.879 . . . . 0.0 109.837 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.99 -51.94 7.54 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.334 -0.854 . . . . 0.0 109.868 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -56.71 -63.17 1.29 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 110.786 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CG ' ' HB1' ' B' ' 34' ' ' ALA . 15.9 m-85 -53.89 -52.31 60.93 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 111.008 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.584 ' OG1' HG13 ' B' ' 35' ' ' VAL . 22.3 m -53.36 -24.93 13.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.933 -1.104 . . . . 0.0 110.086 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -25.56 43.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.929 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.6 -25.35 60.29 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.04 -29.1 64.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.262 -0.899 . . . . 0.0 109.629 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.32 -0.862 . . . . 0.0 110.184 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.1 -29.32 70.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -1.148 . . . . 0.0 110.212 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 93.9 m -56.66 -45.68 81.5 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.249 -0.907 . . . . 0.0 110.239 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -36.79 79.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.364 -0.835 . . . . 0.0 110.281 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.53 -47.79 52.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.273 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -65.27 -58.2 6.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 110.214 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.52 -24.65 5.45 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.21 -0.931 . . . . 0.0 109.858 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -65.81 -57.61 10.67 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.598 ' O ' HG23 ' B' ' 22' ' ' VAL . 1.1 t80 -48.44 -35.85 13.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.423 -1.045 . . . . 0.0 110.394 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.02 -39.19 94.02 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.479 -0.763 . . . . 0.0 110.039 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' B' ' 24' ' ' ARG . 92.9 t -80.76 -21.57 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.952 . . . . 0.0 110.825 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.4 OUTLIER -86.97 -55.14 3.96 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.014 -1.053 . . . . 0.0 109.269 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.598 HG23 ' O ' ' B' ' 18' ' ' TYR . 29.1 t -56.79 -31.07 34.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.716 -0.615 . . . . 0.0 110.475 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' B' ' 23' ' ' LEU . 32.0 mt -87.51 -42.14 12.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.0 110.29 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.419 ' CB ' ' O ' ' B' ' 20' ' ' VAL . 0.2 OUTLIER -71.88 -53.2 13.93 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 110.241 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.29 -35.4 63.72 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.202 -0.936 . . . . 0.0 109.763 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.28 64.14 8.86 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.323 -0.861 . . . . 0.0 110.441 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.56 151.32 64.42 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.675 1.355 . . . . 0.0 110.449 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.41 -22.36 25.08 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.714 1.376 . . . . 0.0 110.313 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.81 116.4 14.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 110.067 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.536 HD11 ' CE2' ' B' ' 18' ' ' TYR . 7.7 tp -80.67 -34.32 34.89 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.365 -0.835 . . . . 0.0 110.261 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.403 ' H ' HG23 ' B' ' 31' ' ' VAL . 48.5 t -51.59 -66.33 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.271 -0.893 . . . . 0.0 110.038 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.03 -40.57 67.19 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.543 -0.723 . . . . 0.0 109.831 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -60.79 -55.09 37.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.409 -0.807 . . . . 0.0 109.688 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.514 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.96 -38.25 61.89 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.395 -0.816 . . . . 0.0 109.997 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.584 HG13 ' OG1' ' A' ' 39' ' ' THR . 81.1 t -77.73 -26.76 15.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 O-C-N 121.248 -0.907 . . . . 0.0 109.838 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -82.3 -51.96 7.39 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.275 -0.891 . . . . 0.0 109.772 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -56.85 -63.01 1.35 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 0.0 110.715 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -54.15 -52.1 62.2 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.926 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.575 ' OG1' HG13 ' A' ' 35' ' ' VAL . 22.4 m -53.37 -25.2 14.49 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.08 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -25.91 43.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 109.84 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.14 -25.41 60.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.242 -0.911 . . . . 0.0 110.03 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -28.99 64.73 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.371 -0.83 . . . . 0.0 109.672 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.199 -179.948 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.54 -27.1 60.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.257 -1.143 . . . . 0.0 110.239 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.09 -61.64 2.31 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.57 -48.37 57.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 0.0 110.371 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.68 -57.91 10.01 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.291 -0.88 . . . . 0.0 110.153 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -60.69 -38.55 85.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -54.09 -42.85 69.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.091 -1.005 . . . . 0.0 109.754 179.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.417 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -56.49 -56.23 25.58 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.844 -1.702 . . . . 0.0 108.844 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.635 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -47.09 -45.86 22.31 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.467 -1.019 . . . . 0.0 110.423 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -61.22 -32.89 72.67 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -0.767 . . . . 0.0 109.86 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 16' ' ' GLN . 48.0 t -82.72 -26.99 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.871 . . . . 0.0 110.664 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -80.12 -59.21 2.8 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.089 -1.007 . . . . 0.0 109.016 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.47 HG11 HD21 ' B' ' 11' ' ' LEU . 20.7 t -54.93 -32.94 27.51 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.883 -0.511 . . . . 0.0 109.8 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.26 -19.86 42.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.082 -1.011 . . . . 0.0 110.215 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.15 -49.45 8.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -0.921 . . . . 0.0 110.504 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.437 ' CG ' ' HD3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -99.99 -23.59 14.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.22 -0.925 . . . . 0.0 110.678 -179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 49.67 71.04 1.7 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.437 ' HD3' ' CG ' ' A' ' 25' ' ' GLN . 44.6 Cg_endo -71.2 154.09 61.96 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.679 1.357 . . . . 0.0 110.379 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.02 -42.14 3.37 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.358 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -110.16 114.64 28.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.26 -0.9 . . . . 0.0 110.152 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.17 -33.75 22.23 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.866 . . . . 0.0 109.93 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.9 t -52.9 -64.79 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 0.0 109.799 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.532 -0.73 . . . . 0.0 109.828 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -53.96 -47.1 71.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.842 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.635 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.34 -46.94 66.3 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.316 -0.865 . . . . 0.0 109.945 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.466 HG23 ' HB3' ' B' ' 38' ' ' PHE . 94.8 t -62.76 -49.12 84.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 O-C-N 121.206 -0.934 . . . . 0.0 109.871 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.42 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -51.28 -56.48 12.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.383 -0.823 . . . . 0.0 110.531 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -53.35 -63.81 1.03 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.452 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 22.8 m-85 -58.29 -53.45 58.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 110.479 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 90.3 m -51.52 -33.66 32.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.138 -0.976 . . . . 0.0 110.164 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.87 -29.83 44.7 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.0 109.979 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.62 -34.79 69.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 110.086 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -31.5 69.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.262 -0.899 . . . . 0.0 110.162 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.206 -0.934 . . . . 0.0 110.204 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -74.59 -27.08 60.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -1.149 . . . . 0.0 110.19 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.04 -61.88 2.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.226 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.34 -48.32 55.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.824 . . . . 0.0 110.454 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.72 -58.02 9.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.55 -38.44 84.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.307 -0.871 . . . . 0.0 110.314 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.598 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -54.24 -42.81 70.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.059 -1.025 . . . . 0.0 109.76 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.418 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -56.6 -56.16 26.06 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.636 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.4 t80 -47.16 -45.79 23.04 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.519 -0.989 . . . . 0.0 110.4 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -61.33 -32.66 72.54 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.52 -0.737 . . . . 0.0 109.963 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.598 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.2 t -82.78 -27.1 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 110.599 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' B' ' 17' ' ' GLY . 1.0 OUTLIER -80.06 -59.24 2.79 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.133 -0.979 . . . . 0.0 109.083 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.476 HG23 ' O ' ' B' ' 18' ' ' TYR . 20.5 t -54.97 -32.71 27.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.801 -0.562 . . . . 0.0 109.857 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.51 -19.79 41.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 0.0 110.134 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -49.48 8.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.252 -0.905 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.435 ' CG ' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -99.98 -23.69 14.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.24 -0.912 . . . . 0.0 110.671 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 49.75 70.97 1.73 Allowed Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.079 -1.013 . . . . 0.0 110.519 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.435 ' HD3' ' CG ' ' B' ' 25' ' ' GLN . 44.4 Cg_endo -71.16 153.93 62.21 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.689 1.363 . . . . 0.0 110.364 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.99 -42.02 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 123.672 1.354 . . . . 0.0 110.299 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -110.36 114.5 28.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.908 . . . . 0.0 110.13 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.99 -33.84 22.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.229 -0.919 . . . . 0.0 109.969 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.0 t -52.82 -64.76 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.327 -0.858 . . . . 0.0 109.837 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.87 -45.86 82.22 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -54.13 -47.2 72.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.245 -0.909 . . . . 0.0 109.807 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.636 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.26 -46.83 65.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 0.0 109.969 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 38' ' ' PHE . 99.3 t -62.96 -49.0 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.278 -0.889 . . . . 0.0 109.873 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.423 ' OE1' ' N ' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -51.32 -56.47 12.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.477 -0.764 . . . . 0.0 110.519 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -53.25 -64.18 0.9 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.0 110.424 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.479 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 23.1 m-85 -58.01 -53.28 60.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.205 -0.935 . . . . 0.0 110.534 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.425 ' OG1' HG13 ' A' ' 35' ' ' VAL . 89.5 m -51.69 -33.63 34.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.075 -1.016 . . . . 0.0 110.113 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -29.88 44.35 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.273 -0.892 . . . . 0.0 110.024 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.45 -35.06 69.65 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.856 . . . . 0.0 110.071 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.73 -31.63 69.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.264 -0.897 . . . . 0.0 110.14 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.252 -179.891 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -32.47 49.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -1.126 . . . . 0.0 110.371 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -59.47 -56.09 26.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.95 . . . . 0.0 110.261 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -51.93 -30.08 22.95 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.366 -0.834 . . . . 0.0 110.383 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.6 tp -69.85 -56.94 5.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.155 -0.966 . . . . 0.0 110.174 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.84 -46.06 89.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.163 -0.961 . . . . 0.0 110.191 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.76 -33.86 50.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.257 -0.902 . . . . 0.0 109.881 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -61.16 -57.63 17.53 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.544 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.1 t80 -45.13 -35.89 3.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.897 . . . . 0.0 110.711 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.665 ' O ' HD23 ' A' ' 23' ' ' LEU . 31.9 m -67.98 -35.1 77.79 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.825 . . . . 0.0 109.952 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.43 -24.38 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.218 -0.926 . . . . 0.0 110.4 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -76.9 -56.71 4.36 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.07 -1.019 . . . . 0.0 108.679 179.501 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 18' ' ' TYR . 46.0 t -56.35 -35.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 121.188 0.518 . . . . 0.0 110.245 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.665 HD23 ' O ' ' A' ' 19' ' ' THR . 3.8 mm? -73.73 -23.11 59.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.255 -0.903 . . . . 0.0 110.377 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.17 -65.39 1.02 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.249 -0.907 . . . . 0.0 110.764 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.79 -29.11 55.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.162 -0.961 . . . . 0.0 110.574 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 53.08 76.81 0.49 Allowed Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 0.0 110.055 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.97 156.69 55.93 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.727 1.382 . . . . 0.0 110.558 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.17 -33.5 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.769 1.405 . . . . 0.0 110.404 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -127.86 116.03 19.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.349 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.419 HD11 ' CE2' ' A' ' 18' ' ' TYR . 11.4 tp -74.35 -44.68 51.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.328 -0.858 . . . . 0.0 110.059 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.436 ' H ' HG23 ' A' ' 31' ' ' VAL . 43.1 t -50.61 -60.85 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.367 -0.833 . . . . 0.0 109.896 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.86 -37.92 77.59 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.629 -0.669 . . . . 0.0 109.945 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 27.8 t80 -62.57 -51.61 66.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.28 -0.888 . . . . 0.0 109.699 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.528 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -36.76 56.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.494 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.7 t -73.94 -51.55 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 O-C-N 121.207 -0.933 . . . . 0.0 110.173 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.24 -29.82 69.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.195 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.428 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 74.5 t80 -78.24 -67.39 0.74 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.283 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -51.69 -44.53 63.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.275 -0.89 . . . . 0.0 110.309 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.479 ' OG1' HG13 ' B' ' 35' ' ' VAL . 47.4 m -54.62 -44.56 73.24 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.724 179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -71.49 -27.15 63.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.332 -0.855 . . . . 0.0 109.814 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.856 . . . . 0.0 110.027 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.67 -26.71 60.03 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.284 -0.885 . . . . 0.0 109.848 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 110.485 179.82 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.45 -32.48 48.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.201 -1.176 . . . . 0.0 110.41 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.2 m -59.4 -56.17 25.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.167 -0.958 . . . . 0.0 110.327 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.9 -29.86 21.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.321 -0.862 . . . . 0.0 110.463 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.11 -56.79 5.99 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.98 -45.93 90.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.936 . . . . 0.0 110.187 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.79 -34.08 51.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.312 -0.867 . . . . 0.0 109.846 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -61.25 -57.53 17.9 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.542 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 2.1 t80 -45.01 -36.12 3.28 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.566 -0.961 . . . . 0.0 110.623 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.649 ' O ' HD23 ' B' ' 23' ' ' LEU . 33.6 m -67.77 -35.14 78.16 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.437 -0.789 . . . . 0.0 110.04 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.45 -24.39 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.236 -0.915 . . . . 0.0 110.399 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.445 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -76.89 -56.65 4.4 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.184 -0.948 . . . . 0.0 108.698 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 18' ' ' TYR . 46.3 t -56.29 -36.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 121.206 0.526 . . . . 0.0 110.188 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.649 HD23 ' O ' ' B' ' 19' ' ' THR . 3.8 mm? -73.51 -23.0 59.97 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.32 -65.36 1.02 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.211 -0.931 . . . . 0.0 110.71 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.89 -28.94 55.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.175 -0.953 . . . . 0.0 110.659 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 52.98 76.95 0.48 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.109 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.11 156.68 55.39 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.765 1.403 . . . . 0.0 110.637 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.12 -33.37 11.74 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.779 1.41 . . . . 0.0 110.448 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -128.12 116.12 19.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 110.259 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.42 HD11 ' CE2' ' B' ' 18' ' ' TYR . 11.4 tp -74.47 -44.66 50.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.217 -0.927 . . . . 0.0 110.023 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.422 HG23 ' H ' ' B' ' 31' ' ' VAL . 43.9 t -50.74 -60.88 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.242 -0.911 . . . . 0.0 109.859 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.61 -37.9 76.84 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.584 -0.698 . . . . 0.0 109.853 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.41 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 27.9 t80 -62.87 -51.35 67.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.304 -0.872 . . . . 0.0 109.654 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.542 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.84 -36.5 58.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.001 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.479 HG13 ' OG1' ' A' ' 39' ' ' THR . 95.6 t -74.18 -51.55 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.262 -0.898 . . . . 0.0 110.059 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.31 -29.39 68.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.253 -0.904 . . . . 0.0 110.377 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.445 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 74.4 t80 -78.53 -67.27 0.76 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.186 -0.946 . . . . 0.0 110.261 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -51.8 -44.54 63.52 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.494 ' OG1' HG13 ' A' ' 35' ' ' VAL . 47.1 m -54.5 -44.53 72.79 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.161 -0.962 . . . . 0.0 109.717 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -71.84 -26.81 62.52 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 109.83 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -63.09 -25.26 68.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 110.037 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.84 -26.68 59.87 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 109.744 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 110.448 179.832 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.506 HD23 ' C ' ' A' ' 11' ' ' LEU . 9.7 tt -75.04 -32.33 61.53 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -1.102 . . . . 0.0 110.094 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.2 m -62.67 -49.47 75.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.0 110.126 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -54.75 -49.96 69.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 110.257 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.85 -50.0 70.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.353 -0.842 . . . . 0.0 110.327 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.487 HD13 ' HA ' ' A' ' 15' ' ' LEU . 1.5 mm? -56.1 -52.44 64.29 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 110.177 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.464 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -52.28 -33.71 43.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.127 -0.983 . . . . 0.0 109.804 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.425 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.88 -55.45 30.49 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 108.803 -1.719 . . . . 0.0 108.803 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.453 ' CE2' HD11 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -49.78 -45.43 49.72 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.366 -1.079 . . . . 0.0 110.396 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 85.3 m -59.08 -35.77 73.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.401 -0.812 . . . . 0.0 110.069 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 16' ' ' GLN . 85.4 t -76.66 -27.06 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.484 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -85.23 -64.22 1.19 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.2 -0.937 . . . . 0.0 109.338 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.408 ' H ' HG23 ' A' ' 22' ' ' VAL . 39.3 t -50.55 -25.76 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.752 -0.592 . . . . 0.0 110.451 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 19' ' ' THR . 19.6 tp -88.36 -25.64 22.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.244 -0.91 . . . . 0.0 110.205 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.64 -56.38 3.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.159 -0.963 . . . . 0.0 110.529 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 26' ' ' GLN . 5.9 pt20 -85.32 -27.03 26.19 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.075 -1.016 . . . . 0.0 110.581 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.463 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.3 OUTLIER 47.87 80.68 0.28 Allowed Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 0.0 110.632 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.74 161.66 44.46 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.622 1.327 . . . . 0.0 110.547 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.3 -36.02 7.64 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.736 1.387 . . . . 0.0 110.236 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -130.08 113.8 14.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.308 -0.87 . . . . 0.0 110.001 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.453 HD11 ' CE2' ' A' ' 18' ' ' TYR . 4.3 tp -67.2 -36.56 81.99 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.0 110.367 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.417 ' H ' HG23 ' A' ' 31' ' ' VAL . 44.0 t -51.3 -65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.216 -0.927 . . . . 0.0 110.091 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.24 -40.87 68.14 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.527 -0.733 . . . . 0.0 109.997 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.5 -46.71 89.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.771 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.666 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -57.78 -44.44 86.23 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.145 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.574 HG13 ' OG1' ' B' ' 39' ' ' THR . 99.0 t -69.91 -34.49 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.301 -0.874 . . . . 0.0 110.021 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.5 40.12 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.279 -0.888 . . . . 0.0 109.751 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 16.1 t80 -76.58 -68.48 0.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.158 -0.964 . . . . 0.0 110.291 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.679 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 17.2 m-85 -51.67 -50.31 60.67 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.224 -0.922 . . . . 0.0 110.575 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.576 ' OG1' HG13 ' B' ' 35' ' ' VAL . 51.8 m -53.14 -39.07 63.24 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.949 -1.094 . . . . 0.0 110.054 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -73.01 -27.21 61.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.33 -0.856 . . . . 0.0 109.989 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.76 -35.47 76.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.358 -0.839 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.1 -38.2 70.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.268 -0.895 . . . . 0.0 110.222 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.223 -0.923 . . . . 0.0 110.576 -179.926 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.487 ' C ' HD23 ' B' ' 11' ' ' LEU . 9.8 tt -75.06 -32.32 61.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.326 -1.102 . . . . 0.0 110.113 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.8 m -62.58 -49.5 75.0 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.344 -0.848 . . . . 0.0 110.15 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -54.73 -49.97 69.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.848 . . . . 0.0 110.267 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.84 -50.13 70.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.264 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.448 ' HA ' HD13 ' B' ' 15' ' ' LEU . 1.5 mm? -56.02 -52.61 63.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.46 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.2 OUTLIER -51.97 -33.99 40.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.11 -0.994 . . . . 0.0 109.856 179.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -57.61 -55.6 29.59 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.88 -1.688 . . . . 0.0 108.88 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.469 ' CE2' HD11 ' B' ' 30' ' ' LEU . 1.0 OUTLIER -49.7 -45.53 49.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.417 -1.049 . . . . 0.0 110.395 179.535 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 84.8 m -58.94 -35.63 73.43 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.418 -0.801 . . . . 0.0 110.072 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.46 HG23 ' O ' ' B' ' 16' ' ' GLN . 83.9 t -76.92 -26.92 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.274 -0.891 . . . . 0.0 110.417 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.444 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -85.29 -64.21 1.19 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.109 -0.995 . . . . 0.0 109.357 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.423 HG23 ' H ' ' B' ' 22' ' ' VAL . 39.2 t -50.57 -25.68 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.716 -0.615 . . . . 0.0 110.329 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.414 ' CB ' ' O ' ' B' ' 19' ' ' THR . 19.9 tp -88.57 -25.53 22.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.118 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.83 -56.32 3.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.167 -0.958 . . . . 0.0 110.494 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.447 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 6.0 pt20 -85.36 -26.94 26.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.153 -0.967 . . . . 0.0 110.596 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.447 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 0.3 OUTLIER 47.86 80.65 0.28 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.177 -0.952 . . . . 0.0 110.524 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.414 ' HD3' ' HG3' ' B' ' 25' ' ' GLN . 45.7 Cg_endo -71.65 161.54 44.94 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.791 1.416 . . . . 0.0 110.567 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -36.09 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.67 1.353 . . . . 0.0 110.212 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -129.86 113.88 15.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -0.894 . . . . 0.0 110.001 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.469 HD11 ' CE2' ' B' ' 18' ' ' TYR . 4.3 tp -67.21 -36.51 81.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 110.374 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.41 HG23 ' H ' ' B' ' 31' ' ' VAL . 43.8 t -51.34 -65.4 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.255 -0.903 . . . . 0.0 110.09 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.52 -40.57 68.73 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.437 -0.79 . . . . 0.0 109.923 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -60.55 -47.0 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.22 -0.925 . . . . 0.0 109.755 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.679 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -57.36 -44.46 84.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.264 -0.898 . . . . 0.0 110.252 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.576 HG13 ' OG1' ' A' ' 39' ' ' THR . 98.1 t -70.06 -34.48 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.204 -0.935 . . . . 0.0 109.987 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.58 40.14 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.359 -0.838 . . . . 0.0 109.748 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.444 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 16.2 t80 -76.42 -68.44 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.981 . . . . 0.0 110.383 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.666 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 17.4 m-85 -51.84 -50.2 61.36 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.574 ' OG1' HG13 ' A' ' 35' ' ' VAL . 51.8 m -53.21 -38.99 63.38 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.082 -1.011 . . . . 0.0 110.047 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -73.08 -27.24 61.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.946 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -35.5 76.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.339 -0.851 . . . . 0.0 110.11 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.07 -38.34 70.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.174 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.64 -179.897 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.759 HD11 HG11 ' B' ' 22' ' ' VAL . 0.2 OUTLIER -86.34 -19.74 29.34 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 0.0 110.312 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.3 m -77.04 -45.64 26.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.237 -0.914 . . . . 0.0 110.286 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -55.05 -57.35 12.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.304 -0.872 . . . . 0.0 110.121 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.03 -54.03 41.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 110.238 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.867 . . . . 0.0 110.244 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.26 -40.03 73.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.145 -0.972 . . . . 0.0 109.787 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.55 -53.65 39.91 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.624 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -48.49 -48.72 37.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.426 -1.044 . . . . 0.0 110.209 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 51.8 m -54.5 -32.5 58.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.474 -0.766 . . . . 0.0 110.221 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.19 -24.62 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.229 -0.919 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.48 ' OE2' ' CE1' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -88.65 -58.55 2.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.743 HG11 HD11 ' B' ' 11' ' ' LEU . 50.4 t -50.59 -41.12 20.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.735 -0.603 . . . . 0.0 110.364 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.2 -34.76 59.29 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.133 -0.98 . . . . 0.0 110.186 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.34 -49.45 14.93 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 110.324 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.09 -37.06 58.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.211 -0.93 . . . . 0.0 110.351 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.431 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 2.1 mt-30 53.21 53.95 12.18 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.237 -0.914 . . . . 0.0 110.285 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 43.5 Cg_endo -70.2 157.13 60.48 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.672 1.354 . . . . 0.0 110.48 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.0 -32.91 10.44 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.653 1.344 . . . . 0.0 110.411 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -120.14 122.75 41.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.229 -0.919 . . . . 0.0 110.281 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 tp -85.69 -36.83 20.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.21 -0.931 . . . . 0.0 110.114 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.459 HG12 ' HD3' ' B' ' 42' ' ' ARG . 45.8 t -51.47 -57.78 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.21 -0.931 . . . . 0.0 109.903 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -62.36 -37.38 85.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.643 -0.661 . . . . 0.0 110.087 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -65.39 -43.17 91.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.274 -0.891 . . . . 0.0 109.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.624 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -57.59 -37.93 74.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.404 -0.81 . . . . 0.0 110.062 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.526 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.2 t -69.71 -50.34 50.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 O-C-N 121.21 -0.931 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.76 -26.09 65.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.505 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.48 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 12.4 t80 -75.82 -68.69 0.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.125 -0.984 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 41' ' ' LEU . 45.3 m-85 -57.81 -47.97 81.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 110.625 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.482 ' OG1' HG13 ' B' ' 35' ' ' VAL . 64.6 m -51.27 -45.52 62.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.12 -0.987 . . . . 0.0 110.023 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -74.0 -26.49 60.47 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.299 -0.875 . . . . 0.0 109.628 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.442 ' HB2' ' HA ' ' A' ' 38' ' ' PHE . 1.3 tp -53.31 -36.55 61.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.932 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -42.15 92.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.319 -0.863 . . . . 0.0 110.113 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.293 -0.879 . . . . 0.0 110.452 -179.886 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.743 HD11 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -86.36 -19.62 29.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -1.136 . . . . 0.0 110.308 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 66.5 m -77.14 -45.66 26.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.239 -0.913 . . . . 0.0 110.269 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -54.98 -57.41 11.79 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.147 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.07 -53.98 42.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.333 -0.855 . . . . 0.0 110.245 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.35 -40.67 74.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -39.76 72.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.116 -0.99 . . . . 0.0 109.922 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.91 -53.47 41.91 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 108.807 -1.717 . . . . 0.0 108.807 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.631 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.5 t80 -48.7 -48.46 40.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.429 -1.042 . . . . 0.0 110.263 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.2 m -54.58 -32.43 58.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.469 -0.769 . . . . 0.0 110.185 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 96.2 t -81.25 -24.85 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 110.54 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.471 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.8 OUTLIER -88.44 -58.47 2.54 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.181 -0.949 . . . . 0.0 109.296 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.759 HG11 HD11 ' A' ' 11' ' ' LEU . 49.8 t -50.67 -40.96 20.11 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.765 -0.584 . . . . 0.0 110.414 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.3 -34.9 59.05 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.175 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.29 -49.35 15.2 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.141 -0.975 . . . . 0.0 110.339 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -76.23 -36.96 58.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.425 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 2.1 mt-30 53.15 53.97 12.29 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.352 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.7 Cg_endo -70.22 157.04 60.75 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.735 1.387 . . . . 0.0 110.503 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.76 -33.1 10.71 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.729 1.384 . . . . 0.0 110.498 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -120.08 123.03 42.39 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.18 -0.95 . . . . 0.0 110.365 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -85.81 -37.12 19.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.074 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.426 HG23 ' H ' ' B' ' 31' ' ' VAL . 46.0 t -51.04 -57.93 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.261 -0.9 . . . . 0.0 110.004 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -62.31 -37.43 85.53 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.527 -0.733 . . . . 0.0 110.17 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.17 -43.45 91.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.854 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.631 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.38 -38.15 73.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.306 -0.871 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.482 HG13 ' OG1' ' A' ' 39' ' ' THR . 99.9 t -69.54 -50.18 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 O-C-N 121.271 -0.893 . . . . 0.0 110.183 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.92 -26.12 65.68 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.298 -0.876 . . . . 0.0 110.512 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.471 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 12.2 t80 -75.91 -68.66 0.55 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.431 ' HA ' ' HB2' ' B' ' 41' ' ' LEU . 45.7 m-85 -57.81 -47.71 81.83 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.909 . . . . 0.0 110.534 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.526 ' OG1' HG13 ' A' ' 35' ' ' VAL . 68.9 m -51.47 -45.64 62.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.022 -1.049 . . . . 0.0 109.963 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -73.74 -26.78 60.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 109.688 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.431 ' HB2' ' HA ' ' B' ' 38' ' ' PHE . 1.3 tp -53.29 -36.55 61.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 109.91 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.459 ' HD3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -59.68 -42.48 93.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 110.036 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.401 -0.812 . . . . 0.0 110.529 -179.884 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.357 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -26.08 30.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.224 -1.163 . . . . 0.0 110.303 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -53.47 -56.4 17.27 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.219 -0.926 . . . . 0.0 110.323 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.46 -50.14 63.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.401 -0.812 . . . . 0.0 110.408 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mp -52.83 -53.49 47.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.342 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 15' ' ' LEU . 4.6 mm? -65.37 -51.89 57.39 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 110.434 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.5 -33.05 43.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.062 -1.024 . . . . 0.0 109.897 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.412 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -59.23 -55.85 28.48 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 108.913 -1.675 . . . . 0.0 108.913 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.458 ' CE2' HD11 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -48.2 -44.78 33.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.407 -1.055 . . . . 0.0 110.391 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -55.63 -37.32 68.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.416 -0.802 . . . . 0.0 110.204 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.6 t -80.56 -25.64 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.671 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -85.67 -58.48 2.64 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.001 -1.062 . . . . 0.0 109.083 179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 22' ' ' VAL . 38.9 t -52.03 -34.09 17.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.757 -0.589 . . . . 0.0 110.179 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.5 -33.9 54.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.07 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.54 -66.28 0.91 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.263 -0.898 . . . . 0.0 110.12 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.71 -40.89 66.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.068 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.49 56.61 13.75 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.307 -0.871 . . . . 0.0 110.364 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.51 151.32 58.85 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.66 1.347 . . . . 0.0 110.295 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.78 -28.39 20.43 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.701 1.369 . . . . 0.0 110.26 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.65 120.05 30.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.315 -0.866 . . . . 0.0 110.086 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.458 HD11 ' CE2' ' A' ' 18' ' ' TYR . 9.4 tp -82.88 -36.63 25.2 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 110.287 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 31' ' ' VAL . 44.8 t -51.02 -63.58 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.186 -0.946 . . . . 0.0 110.112 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.48 -35.76 72.69 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.455 -0.778 . . . . 0.0 110.103 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -66.58 -43.18 85.61 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 109.909 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.595 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -59.77 -35.29 74.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.389 -0.819 . . . . 0.0 110.275 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.483 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.4 t -74.24 -45.56 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 121.224 -0.923 . . . . 0.0 110.341 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.47 -20.64 66.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.25 -0.906 . . . . 0.0 110.373 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.51 -71.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.19 -0.944 . . . . 0.0 110.353 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.563 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 42.8 m-85 -56.48 -47.21 79.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.203 -0.936 . . . . 0.0 110.447 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.471 ' OG1' HG13 ' B' ' 35' ' ' VAL . 86.3 m -51.82 -42.85 62.82 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -75.15 -23.45 57.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.194 -0.941 . . . . 0.0 110.03 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -32.73 74.39 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.291 -0.88 . . . . 0.0 110.033 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -29.4 34.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.304 -0.872 . . . . 0.0 110.017 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.418 -0.802 . . . . 0.0 110.1 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -26.01 31.06 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.281 -1.129 . . . . 0.0 110.263 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 38.9 m -53.64 -56.25 18.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.278 -0.889 . . . . 0.0 110.309 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.58 -50.19 63.48 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.361 -0.837 . . . . 0.0 110.365 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.75 -53.57 46.14 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.388 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.449 HD22 ' N ' ' B' ' 15' ' ' LEU . 4.6 mm? -65.27 -51.9 57.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.216 -0.928 . . . . 0.0 110.404 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.58 -33.09 44.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.085 -1.01 . . . . 0.0 109.905 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -59.15 -55.87 28.38 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 108.929 -1.669 . . . . 0.0 108.929 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.46 ' CE2' HD11 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -48.23 -44.57 33.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.37 -1.077 . . . . 0.0 110.416 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.2 m -55.74 -37.41 68.44 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 110.264 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 86.3 t -80.4 -25.8 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.707 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.6 OUTLIER -85.58 -58.34 2.7 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.999 -1.063 . . . . 0.0 109.158 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 18' ' ' TYR . 38.5 t -52.25 -33.98 17.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.775 -0.578 . . . . 0.0 110.27 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.61 -33.77 53.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.166 -0.959 . . . . 0.0 109.976 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.59 -66.17 0.92 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -0.886 . . . . 0.0 110.105 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.79 -41.02 66.8 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 109.973 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.61 56.51 13.5 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.432 -0.793 . . . . 0.0 110.317 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.32 151.31 60.0 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.603 1.317 . . . . 0.0 110.307 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.65 -28.49 20.9 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.744 1.392 . . . . 0.0 110.327 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.6 120.3 31.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.369 -0.832 . . . . 0.0 110.052 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.46 HD11 ' CE2' ' B' ' 18' ' ' TYR . 9.1 tp -83.18 -36.36 24.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.247 -0.908 . . . . 0.0 110.216 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.424 HG23 ' H ' ' B' ' 31' ' ' VAL . 44.6 t -51.17 -63.44 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.246 -0.909 . . . . 0.0 110.052 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.62 -35.76 72.99 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.412 -0.805 . . . . 0.0 110.17 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -66.55 -43.28 85.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.196 -0.94 . . . . 0.0 109.829 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.563 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -59.66 -35.45 74.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 110.258 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.471 HG13 ' OG1' ' A' ' 39' ' ' THR . 91.0 t -74.24 -45.37 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.184 -0.948 . . . . 0.0 110.359 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.6 -20.56 66.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.57 -71.4 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.147 -0.971 . . . . 0.0 110.36 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.595 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 43.1 m-85 -56.32 -47.2 79.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.928 . . . . 0.0 110.435 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.483 ' OG1' HG13 ' A' ' 35' ' ' VAL . 86.8 m -51.78 -42.88 62.75 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.173 -0.954 . . . . 0.0 110.307 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -75.06 -23.64 58.09 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.266 -0.896 . . . . 0.0 110.064 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -32.88 74.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.225 -0.922 . . . . 0.0 110.069 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -29.44 32.91 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.205 -0.934 . . . . 0.0 109.996 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.819 ' O ' HD12 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.469 HD12 ' HG ' ' B' ' 30' ' ' LEU . 3.9 tp -87.82 -41.01 13.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.263 -1.14 . . . . 0.0 110.116 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.2 m -57.86 -57.61 12.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.976 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.08 21.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.404 -0.81 . . . . 0.0 109.984 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.819 HD12 ' O ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER -77.49 -49.58 14.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 109.997 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.39 -53.1 32.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.268 -0.895 . . . . 0.0 109.991 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.491 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -52.15 -43.16 63.92 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.818 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -55.15 -52.11 49.37 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.623 ' HE2' HD11 ' A' ' 30' ' ' LEU . 1.7 t80 -49.14 -49.34 42.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.405 -1.056 . . . . 0.0 110.17 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.0 m -55.7 -36.62 67.38 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.422 -0.799 . . . . 0.0 110.012 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 16' ' ' GLN . 47.6 t -75.04 -25.1 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.249 -0.907 . . . . 0.0 110.601 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.468 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -86.87 -57.99 2.77 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.178 -0.951 . . . . 0.0 109.254 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 18' ' ' TYR . 41.2 t -48.17 -30.99 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.753 -0.592 . . . . 0.0 110.484 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.8 tp -81.89 -37.71 26.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.189 -0.944 . . . . 0.0 110.128 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -77.62 -27.73 51.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.481 -179.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 3.5 pm0 -135.48 51.26 2.08 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.11 -0.994 . . . . 0.0 110.615 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -37.75 97.98 0.15 Allowed Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.964 -0.46 . . . . 0.0 111.458 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.6 Cg_endo -74.11 166.31 29.88 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.984 1.518 . . . . 0.0 110.552 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.59 -41.7 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.704 1.371 . . . . 0.0 110.273 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -122.04 116.38 24.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.896 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.623 HD11 ' HE2' ' A' ' 18' ' ' TYR . 0.8 OUTLIER -69.83 -45.1 68.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.225 -0.922 . . . . 0.0 109.686 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -51.79 -59.88 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.902 . . . . 0.0 109.881 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.46 -38.74 78.16 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.582 -0.699 . . . . 0.0 109.994 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -60.31 -46.97 88.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.933 . . . . 0.0 109.685 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.722 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -50.96 -38.44 50.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.425 -0.797 . . . . 0.0 110.389 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.486 HG13 ' OG1' ' B' ' 39' ' ' THR . 46.4 t -71.48 -55.28 14.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.214 -0.929 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.37 -38.34 68.72 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.262 -0.899 . . . . 0.0 110.589 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.468 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 14.6 t80 -68.07 -64.87 0.78 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.55 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.728 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 23.1 m-85 -60.23 -45.58 92.74 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.256 -0.902 . . . . 0.0 110.665 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.494 ' OG1' HG13 ' B' ' 35' ' ' VAL . 96.6 m -56.44 -42.45 78.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.0 110.399 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -73.9 -27.11 60.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.12 -0.987 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.19 -36.71 78.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.254 -0.903 . . . . 0.0 110.269 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.58 -40.28 74.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 110.313 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.175 -0.953 . . . . 0.0 110.221 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . 0.84 ' O ' HD12 ' B' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.265 -1.534 . . . . 0.0 109.265 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.532 HD12 ' HG ' ' A' ' 30' ' ' LEU . 3.9 tp -87.84 -40.95 13.58 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.329 -1.101 . . . . 0.0 110.083 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 97.3 m -57.95 -57.54 12.34 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.168 -0.957 . . . . 0.0 109.941 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.15 21.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.365 -0.835 . . . . 0.0 109.911 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.84 HD12 ' O ' ' B' ' 10' ' ' GLY . 1.0 OUTLIER -77.34 -49.86 14.05 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.338 -0.851 . . . . 0.0 109.951 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.31 -52.96 34.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.495 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -52.27 -43.06 64.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.113 -0.992 . . . . 0.0 109.766 179.614 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.419 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -55.33 -51.84 51.64 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 108.826 -1.71 . . . . 0.0 108.826 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.621 ' HE2' HD11 ' B' ' 30' ' ' LEU . 1.7 t80 -49.33 -49.28 44.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.41 -1.053 . . . . 0.0 110.119 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 45.3 m -55.69 -36.71 67.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.452 -0.78 . . . . 0.0 110.049 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 16' ' ' GLN . 47.6 t -75.04 -25.04 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 110.518 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.46 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 1.0 OUTLIER -86.78 -58.2 2.69 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.039 -1.038 . . . . 0.0 109.338 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 18' ' ' TYR . 41.1 t -48.04 -30.89 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.77 -0.582 . . . . 0.0 110.559 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 tp -82.06 -37.6 26.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.97 . . . . 0.0 110.099 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -27.84 50.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.258 -0.901 . . . . 0.0 110.415 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' B' ' 27' ' ' PRO . 3.4 pm0 -135.44 51.45 2.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.135 -0.978 . . . . 0.0 110.52 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' B' ' 22' ' ' VAL . 3.2 mt-30 -37.94 98.05 0.15 Allowed Pre-proline 0 N--CA 1.5 2.035 0 O-C-N 122.009 -0.432 . . . . 0.0 111.464 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 47.8 Cg_endo -74.13 166.25 30.02 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.939 1.494 . . . . 0.0 110.58 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.48 -41.84 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.663 1.349 . . . . 0.0 110.263 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -121.93 116.49 24.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 110.268 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.621 HD11 ' HE2' ' B' ' 18' ' ' TYR . 0.8 OUTLIER -69.99 -45.06 68.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 109.655 179.789 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.0 t -51.72 -59.95 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 109.776 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.41 -38.95 78.43 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.668 -0.645 . . . . 0.0 109.914 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -60.21 -46.86 88.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.927 . . . . 0.0 109.699 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.728 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -50.95 -38.55 51.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.369 -0.832 . . . . 0.0 110.333 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.494 HG13 ' OG1' ' A' ' 39' ' ' THR . 46.4 t -71.39 -55.41 13.89 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.193 -0.942 . . . . 0.0 110.299 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -55.2 -38.4 68.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.46 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 14.6 t80 -68.14 -64.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.888 . . . . 0.0 110.501 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.722 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 23.4 m-85 -60.31 -45.38 93.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.733 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.486 ' OG1' HG13 ' A' ' 35' ' ' VAL . 96.9 m -56.66 -42.23 78.6 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.992 -1.068 . . . . 0.0 110.348 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -74.22 -26.88 60.51 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.29 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.26 -36.58 78.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.0 110.303 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.68 -40.28 75.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.236 -0.915 . . . . 0.0 110.409 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.163 -0.961 . . . . 0.0 110.232 179.933 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -51.16 5.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.174 -1.192 . . . . 0.0 110.27 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 m -52.79 -25.57 11.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.239 -0.913 . . . . 0.0 110.157 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.44 -58.96 3.32 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.165 -0.96 . . . . 0.0 110.239 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.68 -41.47 73.76 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.098 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.29 -44.81 95.05 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.328 -0.857 . . . . 0.0 110.087 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.05 -38.56 65.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.956 . . . . 0.0 109.698 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.53 -58.39 14.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.76 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.7 t80 -46.0 -40.24 10.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.511 -0.993 . . . . 0.0 110.685 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.2 m -62.7 -36.01 81.57 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.388 -0.82 . . . . 0.0 110.01 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 96.8 t -82.18 -21.84 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.26 -0.9 . . . . 0.0 110.745 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.454 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.24 8.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.028 -1.045 . . . . 0.0 109.332 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 18' ' ' TYR . 76.9 t -60.71 -34.5 59.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 121.7 -0.625 . . . . 0.0 110.408 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.36 -41.32 22.18 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.124 -0.985 . . . . 0.0 110.277 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -69.57 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.38 -36.87 64.35 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.253 -0.904 . . . . 0.0 110.173 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.11 59.6 14.47 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.23 -0.919 . . . . 0.0 110.157 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.98 149.8 59.73 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.715 1.376 . . . . 0.0 110.508 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.99 -29.98 17.25 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.723 1.38 . . . . 0.0 110.294 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -125.06 119.64 29.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -78.6 -35.68 45.39 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.246 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -51.05 -68.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.228 -0.92 . . . . 0.0 110.108 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.99 -41.54 71.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.469 -0.77 . . . . 0.0 109.785 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -58.58 -51.81 68.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.534 179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.76 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -53.66 -44.62 69.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.439 -0.788 . . . . 0.0 110.022 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.629 HG13 ' OG1' ' B' ' 39' ' ' THR . 92.9 t -71.04 -29.74 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 O-C-N 121.315 -0.866 . . . . 0.0 110.07 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.23 -26.6 39.02 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.259 -0.901 . . . . 0.0 109.586 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.454 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 27.8 t80 -76.57 -68.12 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.206 -0.933 . . . . 0.0 110.427 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -52.94 -45.81 67.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.304 -0.872 . . . . 0.0 110.65 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.618 ' OG1' HG13 ' B' ' 35' ' ' VAL . 24.0 m -54.51 -40.89 69.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.983 -1.073 . . . . 0.0 109.889 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -28.75 68.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 mt -75.57 -24.65 56.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 110.337 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -47.91 50.11 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.225 -0.922 . . . . 0.0 109.695 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.356 -0.84 . . . . 0.0 110.047 179.871 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.58 -51.06 5.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.134 -1.215 . . . . 0.0 110.293 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 69.3 m -52.98 -25.57 12.48 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.224 -0.922 . . . . 0.0 110.205 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -69.33 -59.09 3.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 110.16 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.51 -41.56 73.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.14 -44.91 94.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.191 -0.943 . . . . 0.0 110.128 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -38.58 65.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -57.74 -58.23 15.66 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.93 -1.668 . . . . 0.0 108.93 179.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.771 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.7 t80 -45.92 -40.33 10.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.534 -0.98 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 80.1 m -62.72 -35.97 81.47 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.104 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 98.8 t -82.27 -21.72 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.749 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.464 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.39 8.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.082 -1.011 . . . . 0.0 109.213 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 18' ' ' TYR . 73.6 t -60.6 -34.55 58.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.762 -0.586 . . . . 0.0 110.452 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.26 -41.34 22.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.122 -0.986 . . . . 0.0 110.251 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -69.62 0.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.302 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.24 -36.75 63.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.304 -0.873 . . . . 0.0 110.269 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 51.94 59.77 14.47 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.267 -0.896 . . . . 0.0 110.174 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.02 149.76 59.43 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.682 1.359 . . . . 0.0 110.529 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -71.04 -29.98 17.06 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.655 1.345 . . . . 0.0 110.327 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -125.03 119.6 29.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.134 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -78.43 -35.9 46.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.191 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.5 t -50.88 -68.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.277 -0.89 . . . . 0.0 110.203 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.94 -41.61 71.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.394 -0.816 . . . . 0.0 109.711 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -58.54 -51.99 67.56 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.294 -0.879 . . . . 0.0 109.511 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.771 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -53.66 -44.5 69.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.363 -0.836 . . . . 0.0 110.027 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.618 HG13 ' OG1' ' A' ' 39' ' ' THR . 90.9 t -71.13 -29.73 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.269 -0.895 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.06 -26.6 39.59 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.241 -0.912 . . . . 0.0 109.546 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.464 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 27.8 t80 -76.67 -68.03 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.17 -0.956 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -53.03 -45.7 68.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.592 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.629 ' OG1' HG13 ' A' ' 35' ' ' VAL . 23.8 m -54.55 -41.11 69.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.022 -1.049 . . . . 0.0 109.753 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -28.83 68.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.188 -0.945 . . . . 0.0 109.974 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.1 mt -75.64 -24.65 56.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 110.341 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -47.78 51.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.169 -0.957 . . . . 0.0 109.684 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.972 179.841 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -38.49 91.02 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -1.158 . . . . 0.0 110.204 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -53.79 -43.18 69.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.347 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.86 -25.34 66.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.924 . . . . 0.0 110.367 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD21 ' HE1' ' A' ' 38' ' ' PHE . 2.6 tp -71.68 -53.07 14.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.4 mt -60.2 -44.49 95.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.08 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -38.21 63.42 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.173 -0.955 . . . . 0.0 109.878 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.29 -57.05 21.16 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.636 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.8 t80 -46.65 -40.57 13.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.524 -0.986 . . . . 0.0 110.575 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.7 m -62.3 -36.57 82.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.394 -0.816 . . . . 0.0 110.267 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.82 -23.37 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.338 -0.851 . . . . 0.0 110.713 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 1.3 mt-10 -87.43 -54.36 4.33 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.01 -1.056 . . . . 0.0 109.246 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.15 -33.79 25.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.281 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 mt -78.35 -36.36 46.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.133 -0.98 . . . . 0.0 110.158 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -55.85 4.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.219 -0.926 . . . . 0.0 110.193 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' A' ' 27' ' ' PRO . 1.0 OUTLIER -61.18 -44.13 97.79 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.294 -0.879 . . . . 0.0 110.203 -179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.63 58.13 14.83 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.296 -0.877 . . . . 0.0 110.312 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' A' ' 25' ' ' GLN . 45.5 Cg_endo -72.35 156.69 54.48 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.589 1.31 . . . . 0.0 110.364 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.45 -19.05 33.33 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.743 1.391 . . . . 0.0 110.509 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.13 119.36 15.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.256 -0.902 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -81.16 -36.25 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.136 -0.977 . . . . 0.0 110.017 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.68 -65.5 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -0.909 . . . . 0.0 109.765 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.24 -41.73 76.19 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.427 -0.795 . . . . 0.0 109.732 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -57.65 -49.23 77.17 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.344 -0.847 . . . . 0.0 109.657 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.657 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -51.93 -34.97 44.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.357 -0.839 . . . . 0.0 110.226 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.29 -53.42 17.23 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.347 -0.846 . . . . 0.0 110.427 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.23 -23.15 46.12 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.0 110.319 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -79.1 -68.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.266 -0.896 . . . . 0.0 110.377 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.655 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 13.1 m-85 -57.08 -45.72 83.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.237 -0.914 . . . . 0.0 110.39 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.403 ' OG1' HG13 ' B' ' 35' ' ' VAL . 83.5 m -53.57 -48.88 68.76 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.937 . . . . 0.0 110.442 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -35.56 80.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.148 -0.97 . . . . 0.0 110.257 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.3 -43.39 67.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.0 110.27 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 -44.44 62.66 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.182 -0.949 . . . . 0.0 110.452 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.99 179.843 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.35 90.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.284 -1.127 . . . . 0.0 110.171 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.0 m -54.03 -43.04 69.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.396 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.82 -25.4 66.42 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.277 -0.889 . . . . 0.0 110.317 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.493 HD21 ' HE1' ' B' ' 38' ' ' PHE . 2.5 tp -71.72 -52.85 15.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.242 -0.911 . . . . 0.0 110.256 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.36 -44.27 95.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.905 . . . . 0.0 110.067 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -38.3 64.26 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.141 -0.974 . . . . 0.0 109.774 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.13 -57.18 20.4 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.642 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.8 t80 -46.6 -40.39 12.82 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.53 -0.982 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -62.6 -36.29 82.26 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.437 -0.789 . . . . 0.0 110.296 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.96 -23.39 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.759 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 1.3 mt-10 -87.58 -54.18 4.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.056 -1.028 . . . . 0.0 109.289 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.18 -33.49 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 O-C-N 121.786 -0.571 . . . . 0.0 110.294 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' B' ' 23' ' ' LEU . 9.3 mt -78.6 -36.46 44.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.135 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.11 -55.83 4.31 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' B' ' 27' ' ' PRO . 1.0 OUTLIER -61.26 -44.01 97.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.6 58.1 14.88 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.319 -0.863 . . . . 0.0 110.383 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' B' ' 25' ' ' GLN . 45.9 Cg_endo -72.42 156.62 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.586 1.309 . . . . 0.0 110.498 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.27 -19.15 34.03 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.709 1.373 . . . . 0.0 110.47 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.16 119.19 15.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.236 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.98 -36.23 31.03 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.022 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.402 HG23 ' H ' ' B' ' 31' ' ' VAL . 41.1 t -53.62 -65.67 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.289 -0.882 . . . . 0.0 109.789 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.06 -41.71 75.48 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.52 -0.737 . . . . 0.0 109.744 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.327 -0.858 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.655 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -52.18 -34.89 47.14 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.348 -0.845 . . . . 0.0 110.194 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.403 HG13 ' OG1' ' A' ' 39' ' ' THR . 61.5 t -74.29 -53.51 16.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.349 -0.844 . . . . 0.0 110.452 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -57.14 -23.24 45.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.428 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -79.06 -68.18 0.68 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.275 -0.891 . . . . 0.0 110.438 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.657 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 13.2 m-85 -57.2 -45.75 83.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.154 -0.966 . . . . 0.0 110.414 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -53.42 -49.22 67.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.255 -0.903 . . . . 0.0 110.436 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.05 -35.78 81.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.155 -0.965 . . . . 0.0 110.298 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.13 -43.42 66.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.5 -44.55 62.56 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.293 -0.879 . . . . 0.0 110.47 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.29 -0.881 . . . . 0.0 109.965 179.828 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 p80 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.206 0.527 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 ttp -118.92 -31.87 4.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.292 -0.88 . . . . 0.0 110.302 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -169.81 -167.08 29.8 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.46 ' C ' HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -103.26 18.71 21.14 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.265 -1.138 . . . . 0.0 110.356 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.46 HD12 ' C ' ' A' ' 4' ' ' HIS . 4.2 mp -134.46 100.1 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.2 -0.937 . . . . 0.0 110.035 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.02 50.27 0.79 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.311 -0.868 . . . . 0.0 110.113 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.498 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.3 tt -58.96 130.6 86.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 O-C-N 121.286 -0.884 . . . . 0.0 110.153 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD2' HG13 ' A' ' 7' ' ' ILE . 46.5 Cg_endo -72.61 137.04 26.93 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.495 1.26 . . . . 0.0 110.398 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.7 178.72 5.98 Favored 'Trans proline' 0 C--N 1.312 -1.366 0 O-C-N 123.535 1.281 . . . . 0.0 110.472 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.0 -32.42 6.4 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.765 HD21 HG11 ' B' ' 22' ' ' VAL . 0.1 OUTLIER -68.67 -57.33 5.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.208 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 79.6 m -52.4 -28.58 20.36 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.242 -0.911 . . . . 0.0 110.262 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -72.04 -59.19 2.87 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.625 HD23 ' HE1' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -55.18 -39.44 69.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.923 . . . . 0.0 110.199 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.0 mt -62.91 -43.99 97.3 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.179 -0.95 . . . . 0.0 109.957 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.36 -37.95 65.53 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.16 -0.963 . . . . 0.0 109.653 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.44 -55.24 30.69 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 108.977 -1.649 . . . . 0.0 108.977 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.58 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.6 t80 -48.14 -38.83 18.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.404 -1.057 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.85 -36.52 83.53 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.472 -0.768 . . . . 0.0 110.165 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.0 t -80.9 -25.07 10.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.773 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.467 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.6 mt-10 -82.69 -57.15 3.45 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.177 -0.952 . . . . 0.0 109.273 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.7 HG11 HD21 ' B' ' 11' ' ' LEU . 22.6 t -55.53 -32.91 31.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 CA-C-O 121.295 0.569 . . . . 0.0 110.126 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.1 -34.53 63.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.261 -0.9 . . . . 0.0 110.233 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.49 -62.59 1.37 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.204 -0.935 . . . . 0.0 110.362 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.16 -43.12 63.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.216 -0.927 . . . . 0.0 110.313 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.42 62.41 11.2 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.287 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.23 161.62 45.2 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 O-C-N 123.734 1.386 . . . . 0.0 110.527 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.19 -34.12 10.52 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.638 1.336 . . . . 0.0 110.423 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -129.05 123.85 33.38 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.289 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 tp -77.7 -40.9 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.262 -0.898 . . . . 0.0 110.176 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.427 ' H ' HG23 ' A' ' 31' ' ' VAL . 47.1 t -50.74 -65.37 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.248 -0.907 . . . . 0.0 110.019 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.21 -38.95 71.72 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.5 -0.75 . . . . 0.0 110.07 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -62.17 -46.44 88.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.209 -0.932 . . . . 0.0 109.878 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.626 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.33 -33.28 58.58 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.364 -0.835 . . . . 0.0 110.197 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.417 HG13 ' OG1' ' B' ' 39' ' ' THR . 85.7 t -74.96 -49.97 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.333 -0.855 . . . . 0.0 110.248 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.32 -41.03 96.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.236 -0.915 . . . . 0.0 110.332 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.467 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.2 t80 -61.5 -60.12 4.19 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.918 . . . . 0.0 110.3 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.64 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 12.5 m-85 -63.62 -47.78 79.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.431 ' OG1' HG13 ' B' ' 35' ' ' VAL . 54.6 m -52.98 -29.88 31.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.184 -0.948 . . . . 0.0 109.939 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.13 -34.5 37.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.336 -0.852 . . . . 0.0 109.827 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -23.08 63.76 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.322 -0.861 . . . . 0.0 110.068 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.7 ttt180 -75.36 -26.4 58.5 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.221 -0.924 . . . . 0.0 109.732 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -105.76 8.14 32.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.31 -0.869 . . . . 0.0 110.484 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -92.98 -65.32 1.01 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.023 -1.048 . . . . 0.0 110.116 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.79 106.39 0.09 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.556 -0.715 . . . . 0.0 110.59 -179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 19.7 mtt180 . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.258 -179.838 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 28.0 p80 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.204 0.526 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.9 ttp -119.01 -31.52 4.72 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.287 -0.883 . . . . 0.0 110.298 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -170.03 -167.28 30.28 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . 0.462 ' C ' HD12 ' B' ' 5' ' ' ILE . 0.2 OUTLIER -103.19 18.73 21.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.293 -1.122 . . . . 0.0 110.423 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.462 HD12 ' C ' ' B' ' 4' ' ' HIS . 4.2 mp -134.59 100.22 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.181 -0.95 . . . . 0.0 109.975 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.04 50.34 0.79 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.268 -0.895 . . . . 0.0 110.073 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.492 ' O ' HG23 ' B' ' 7' ' ' ILE . 1.3 tt -58.97 130.57 86.47 Favored Pre-proline 0 C--N 1.305 -1.353 0 O-C-N 121.266 -0.896 . . . . 0.0 110.164 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.409 ' HD2' HG13 ' B' ' 7' ' ' ILE . 45.9 Cg_endo -72.6 137.01 26.89 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.461 1.243 . . . . 0.0 110.47 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.71 178.65 6.06 Favored 'Trans proline' 0 C--N 1.312 -1.352 0 O-C-N 123.574 1.302 . . . . 0.0 110.431 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.26 -32.81 6.1 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.7 HD21 HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -68.44 -57.45 5.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.217 -1.167 . . . . 0.0 110.235 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.6 m -52.27 -28.6 19.47 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.206 -0.934 . . . . 0.0 110.315 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -71.94 -59.2 2.86 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.184 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.614 HD23 ' HE1' ' B' ' 38' ' ' PHE . 0.2 OUTLIER -55.27 -39.16 69.49 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.261 -0.9 . . . . 0.0 110.289 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 71.4 mt -63.18 -43.96 96.78 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.239 -0.913 . . . . 0.0 109.997 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.44 -37.88 65.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.216 -0.928 . . . . 0.0 109.65 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.408 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.31 -55.35 29.96 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.583 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.6 t80 -48.14 -38.82 18.85 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -1.048 . . . . 0.0 110.363 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -36.32 82.93 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.465 -0.772 . . . . 0.0 110.211 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 90.4 t -80.98 -25.24 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.789 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.7 mt-10 -82.53 -57.14 3.47 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.1 -1.0 . . . . 0.0 109.284 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.765 HG11 HD21 ' A' ' 11' ' ' LEU . 22.4 t -55.63 -32.75 31.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 O-C-N 121.708 -0.62 . . . . 0.0 110.101 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.3 -34.38 63.49 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -92.65 -62.41 1.4 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.25 -0.906 . . . . 0.0 110.346 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -52.27 -43.22 64.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.311 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.51 62.41 11.12 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.281 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.22 161.51 45.58 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.692 1.364 . . . . 0.0 110.538 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.0 -34.33 10.61 Favored 'Trans proline' 0 C--N 1.31 -1.471 0 O-C-N 123.723 1.38 . . . . 0.0 110.456 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -128.89 124.09 34.32 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.287 -0.883 . . . . 0.0 110.226 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 tp -77.8 -41.05 38.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 110.082 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.417 HG23 ' H ' ' B' ' 31' ' ' VAL . 46.6 t -50.52 -65.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.245 -0.909 . . . . 0.0 110.046 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.17 -38.99 71.67 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.487 -0.758 . . . . 0.0 110.041 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -62.07 -46.5 88.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.228 -0.92 . . . . 0.0 109.898 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.64 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -54.3 -33.44 58.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.437 -0.79 . . . . 0.0 110.217 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.431 HG13 ' OG1' ' A' ' 39' ' ' THR . 86.7 t -74.87 -49.84 27.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.347 0 O-C-N 121.228 -0.92 . . . . 0.0 110.216 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.55 -40.76 95.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.353 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 33.0 t80 -61.65 -60.22 4.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.198 -0.939 . . . . 0.0 110.282 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.626 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 12.5 m-85 -63.48 -47.61 81.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 110.343 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.417 ' OG1' HG13 ' A' ' 35' ' ' VAL . 52.9 m -53.13 -29.94 34.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.123 -0.986 . . . . 0.0 109.972 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.1 -34.49 37.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.862 . . . . 0.0 109.87 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.11 -23.09 63.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.337 -0.852 . . . . 0.0 110.084 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -75.43 -26.47 58.37 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.281 -0.887 . . . . 0.0 109.695 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -105.71 8.03 32.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.893 . . . . 0.0 110.499 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -92.73 -65.41 1.0 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.03 -1.044 . . . . 0.0 110.123 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.74 106.34 0.09 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.594 -0.691 . . . . 0.0 110.611 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.276 -179.832 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 67.1 m80 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.252 0.548 . . . . 0.0 110.197 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ttp -105.61 -42.19 5.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.231 -0.918 . . . . 0.0 110.168 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.47 158.1 0.88 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -134.65 -50.57 0.78 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.316 -1.108 . . . . 0.0 110.193 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -120.06 45.66 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.361 -0.837 . . . . 0.0 110.161 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -141.13 38.65 1.76 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.246 -0.909 . . . . 0.0 110.288 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.2 mm -115.26 119.7 37.97 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.188 -0.945 . . . . 0.0 110.131 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.71 113.77 3.84 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 O-C-N 123.548 1.288 . . . . 0.0 110.402 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.2 151.3 48.96 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 O-C-N 123.547 1.288 . . . . 0.0 110.332 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.69 -27.06 21.48 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.94 -32.38 72.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.208 -1.172 . . . . 0.0 110.188 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.8 m -69.72 -30.88 68.61 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.158 -0.964 . . . . 0.0 110.228 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -71.48 -54.54 10.26 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.269 -0.894 . . . . 0.0 110.208 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.855 HD21 ' CE1' ' A' ' 38' ' ' PHE . 1.0 OUTLIER -55.59 -53.56 54.91 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.261 -0.899 . . . . 0.0 110.241 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.852 HD11 HD11 ' B' ' 15' ' ' LEU . 1.2 mm? -53.55 -38.86 64.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.227 -0.921 . . . . 0.0 110.193 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -43.93 70.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.14 -0.975 . . . . 0.0 109.956 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -55.67 -55.69 27.5 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.474 ' CD2' HG21 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -49.24 -47.48 46.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.42 -1.047 . . . . 0.0 110.31 179.552 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.409 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 77.7 m -53.15 -36.18 60.56 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.393 -0.817 . . . . 0.0 110.316 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.26 -25.0 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.174 -0.954 . . . . 0.0 110.417 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.4 mt-10 -89.13 -60.15 2.03 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.21 -0.931 . . . . 0.0 109.2 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.474 HG21 ' CD2' ' A' ' 18' ' ' TYR . 25.4 t -53.59 -26.71 13.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.75 -0.594 . . . . 0.0 110.116 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.409 ' CB ' ' O ' ' A' ' 19' ' ' THR . 2.7 tp -85.08 -35.69 21.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.295 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.27 -56.25 3.34 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.362 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.39 -41.94 81.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.158 -0.964 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 52.04 59.07 15.19 Favored Pre-proline 0 N--CA 1.493 1.686 0 O-C-N 121.245 -0.909 . . . . 0.0 110.161 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.26 156.77 58.53 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.675 1.355 . . . . 0.0 110.573 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.45 -27.48 19.05 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.764 1.402 . . . . 0.0 110.453 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.19 119.93 21.54 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.41 -32.63 28.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.142 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.504 HG12 ' HD3' ' B' ' 42' ' ' ARG . 39.8 t -53.14 -64.67 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.251 -0.905 . . . . 0.0 109.829 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.91 77.81 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.527 -0.733 . . . . 0.0 109.958 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.55 -48.38 81.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.211 -0.931 . . . . 0.0 109.521 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.518 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -55.4 -35.06 64.93 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.873 . . . . 0.0 109.585 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.432 ' CG1' ' OG1' ' B' ' 39' ' ' THR . 55.3 t -81.85 -44.37 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 O-C-N 121.424 -0.797 . . . . 0.0 109.723 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.99 -26.76 66.96 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.222 -0.924 . . . . 0.0 109.855 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.442 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 38.3 t80 -78.88 -68.02 0.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.181 -0.949 . . . . 0.0 110.296 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.855 ' CE1' HD21 ' A' ' 14' ' ' LEU . 17.0 m-85 -52.21 -50.97 60.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.206 -0.934 . . . . 0.0 110.49 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.423 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 90.4 m -50.68 -52.92 35.5 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.179 -0.951 . . . . 0.0 110.36 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -63.43 -24.07 67.68 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.14 -0.975 . . . . 0.0 109.959 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.483 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.1 tt -65.05 -29.35 70.23 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.311 -0.868 . . . . 0.0 109.997 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.44 ' HD3' HG12 ' B' ' 31' ' ' VAL . 0.1 OUTLIER -60.22 -58.14 9.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.332 -0.855 . . . . 0.0 110.174 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -60.63 -23.74 64.99 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.324 -0.86 . . . . 0.0 110.35 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 41' ' ' LEU . . . -60.74 -71.86 0.13 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.287 -0.883 . . . . 0.0 110.449 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -49.77 -32.83 14.71 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.522 -0.736 . . . . 0.0 110.659 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.227 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 67.4 m80 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.303 0.573 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ttp -105.52 -42.28 5.26 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.315 -0.866 . . . . 0.0 110.196 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.55 158.16 0.91 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -134.75 -50.72 0.78 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -1.16 . . . . 0.0 110.137 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -119.95 45.56 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.402 -0.811 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -140.9 38.59 1.8 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 110.352 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 36.1 mm -115.35 119.75 37.71 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.259 -0.901 . . . . 0.0 110.085 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.7 113.69 3.81 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 O-C-N 123.523 1.275 . . . . 0.0 110.5 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.03 151.39 49.95 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.591 1.311 . . . . 0.0 110.361 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.46 -26.96 21.72 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.5 tp -67.94 -32.46 72.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -1.149 . . . . 0.0 110.144 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 86.0 m -69.8 -30.68 68.28 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.304 -0.872 . . . . 0.0 110.238 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -71.61 -54.4 10.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.244 -0.91 . . . . 0.0 110.232 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.848 HD21 ' CE1' ' B' ' 38' ' ' PHE . 1.0 OUTLIER -55.77 -53.51 55.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.852 HD11 HD11 ' A' ' 15' ' ' LEU . 1.2 mm? -53.5 -38.96 64.2 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.32 -0.863 . . . . 0.0 110.208 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -44.17 70.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.283 -0.886 . . . . 0.0 109.946 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.41 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -55.37 -55.96 25.83 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.488 ' CD2' HG21 ' B' ' 22' ' ' VAL . 0.9 OUTLIER -49.0 -47.49 44.36 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.373 -1.075 . . . . 0.0 110.401 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.412 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 76.1 m -53.22 -36.14 60.7 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.423 -0.798 . . . . 0.0 110.323 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -78.19 -25.2 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.246 -0.909 . . . . 0.0 110.4 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.455 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.4 mt-10 -88.91 -60.14 2.04 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.236 -0.915 . . . . 0.0 109.257 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.488 HG21 ' CD2' ' B' ' 18' ' ' TYR . 25.0 t -53.51 -26.78 13.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.676 -0.64 . . . . 0.0 110.149 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.412 ' CB ' ' O ' ' B' ' 19' ' ' THR . 2.7 tp -85.05 -35.73 21.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 -56.32 3.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.893 . . . . 0.0 110.335 -179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.26 -41.88 80.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.135 -0.978 . . . . 0.0 110.49 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 51.92 59.17 15.22 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.192 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 156.89 57.87 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 O-C-N 123.755 1.397 . . . . 0.0 110.535 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -71.54 -27.48 18.75 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.676 1.356 . . . . 0.0 110.411 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -132.2 119.9 21.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -0.902 . . . . 0.0 110.227 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -82.37 -32.84 29.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.886 . . . . 0.0 110.16 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.44 HG12 ' HD3' ' A' ' 42' ' ' ARG . 39.8 t -52.9 -64.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.264 -0.897 . . . . 0.0 109.865 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -57.07 -40.94 77.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.558 -0.714 . . . . 0.0 109.976 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -61.44 -48.52 80.8 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.19 -0.944 . . . . 0.0 109.54 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.508 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -55.32 -35.28 64.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.375 -0.828 . . . . 0.0 109.573 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.423 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 57.1 t -81.66 -44.17 20.19 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 O-C-N 121.477 -0.764 . . . . 0.0 109.783 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.27 -26.65 66.67 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.215 -0.928 . . . . 0.0 109.817 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.455 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 38.4 t80 -78.98 -67.9 0.71 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.146 -0.971 . . . . 0.0 110.283 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.848 ' CE1' HD21 ' B' ' 14' ' ' LEU . 16.9 m-85 -52.22 -51.01 60.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.239 -0.913 . . . . 0.0 110.426 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.432 ' OG1' ' CG1' ' A' ' 35' ' ' VAL . 84.8 m -50.69 -52.94 35.31 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -63.38 -24.2 67.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.342 -0.849 . . . . 0.0 109.955 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.488 ' O ' ' HB3' ' B' ' 44' ' ' ALA . 1.1 tt -64.91 -29.33 70.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.504 ' HD3' HG12 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -60.22 -58.25 9.3 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.328 -0.857 . . . . 0.0 110.127 179.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -60.52 -23.64 64.72 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' B' ' 41' ' ' LEU . . . -61.0 -71.81 0.13 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.471 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -49.64 -32.89 14.03 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.54 -0.725 . . . . 0.0 110.727 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 5.6 m80 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.42 76.81 0.69 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.241 -0.912 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.27 -139.96 14.92 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.0 169.97 18.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.187 -1.184 . . . . 0.0 110.219 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.423 ' N ' HD12 ' A' ' 5' ' ' ILE . 4.3 mp -113.92 148.84 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.263 -0.898 . . . . 0.0 110.073 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -131.07 143.52 50.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.251 -0.906 . . . . 0.0 110.117 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.453 HD12 ' C ' ' A' ' 7' ' ' ILE . 1.3 pp -146.83 58.32 4.25 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.279 -0.888 . . . . 0.0 110.442 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.36 145.76 54.56 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.75 1.395 . . . . 0.0 110.706 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -74.32 -171.69 0.98 Allowed 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.705 1.371 . . . . 0.0 110.425 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.32 -43.84 2.8 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.3 tp -77.5 -38.57 48.67 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -1.152 . . . . 0.0 110.37 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.7 m -63.46 -37.93 89.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.205 -0.935 . . . . 0.0 110.383 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -54.04 -41.76 68.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.0 110.282 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.56 -44.13 71.52 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.225 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.687 HD21 ' HD2' ' B' ' 18' ' ' TYR . 91.8 mt -67.83 -51.58 46.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.277 -0.889 . . . . 0.0 110.173 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.42 -34.61 25.11 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.068 -1.02 . . . . 0.0 109.932 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.44 -58.74 12.81 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 108.75 -1.74 . . . . 0.0 108.75 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.673 ' HD2' HD21 ' B' ' 15' ' ' LEU . 1.3 t80 -47.54 -44.56 26.05 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.447 -1.031 . . . . 0.0 110.663 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 m -50.74 -55.72 15.36 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.048 -1.033 . . . . 0.0 108.906 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.79 -44.27 98.17 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -52.55 -69.05 0.12 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.426 0.632 . . . . 0.0 110.768 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.7 t -52.44 -22.74 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.389 -0.819 . . . . 0.0 110.519 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.88 -20.99 34.42 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.92 . . . . 0.0 110.195 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.77 -56.53 2.26 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.215 -0.928 . . . . 0.0 110.163 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -57.09 -43.58 82.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.26 -0.9 . . . . 0.0 110.148 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.454 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 0.0 OUTLIER 52.57 52.79 11.43 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.372 -0.83 . . . . 0.0 110.162 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 45.1 Cg_endo -71.28 156.18 59.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.633 1.333 . . . . 0.0 110.395 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.33 -29.84 16.4 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.658 1.346 . . . . 0.0 110.167 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.64 119.59 29.45 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.32 -0.862 . . . . 0.0 110.051 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.46 -41.93 23.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.295 -0.878 . . . . 0.0 110.346 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.558 HG12 ' HG2' ' B' ' 42' ' ' ARG . 41.2 t -50.7 -59.81 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.234 -0.916 . . . . 0.0 110.047 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -62.01 -36.02 80.28 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.508 -0.745 . . . . 0.0 110.024 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.419 ' HD2' ' HH ' ' A' ' 18' ' ' TYR . 53.3 t80 -65.49 -44.11 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.287 -0.883 . . . . 0.0 109.706 179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.425 ' CA ' ' OH ' ' A' ' 18' ' ' TYR . . . -57.12 -36.07 70.22 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.443 -0.786 . . . . 0.0 110.124 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.541 HG13 ' OG1' ' B' ' 39' ' ' THR . 98.1 t -78.06 -44.91 27.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.239 -0.913 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.56 -30.29 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.386 -0.821 . . . . 0.0 110.55 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -76.71 -58.26 3.38 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.157 -0.964 . . . . 0.0 110.376 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.404 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 12.6 m-85 -65.57 -43.17 90.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 110.546 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.488 ' OG1' HG13 ' B' ' 35' ' ' VAL . 53.7 m -54.68 -44.83 73.69 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.134 -0.979 . . . . 0.0 110.081 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.91 -31.92 72.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.172 -0.955 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.07 -28.19 68.65 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 109.975 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.425 ' HG2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -68.6 -30.32 69.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 110.138 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.03 -33.89 75.45 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.293 -0.88 . . . . 0.0 110.072 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.94 -64.42 0.82 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.829 . . . . 0.0 110.234 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -48.96 160.58 0.18 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.597 -0.689 . . . . 0.0 110.558 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.255 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 5.6 m80 . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.23 0.538 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.45 76.72 0.69 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.295 -0.878 . . . . 0.0 110.142 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.25 -139.85 14.87 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.02 169.88 18.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.185 -1.185 . . . . 0.0 110.319 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.425 HD12 ' N ' ' B' ' 5' ' ' ILE . 4.3 mp -113.86 148.76 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.33 -0.856 . . . . 0.0 110.038 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -131.1 143.43 50.65 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.182 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.45 ' C ' HD12 ' B' ' 7' ' ' ILE . 1.3 pp -146.84 58.54 4.41 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.271 -0.893 . . . . 0.0 110.364 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.49 145.85 54.03 Favored 'Trans proline' 0 C--N 1.311 -1.433 0 O-C-N 123.64 1.337 . . . . 0.0 110.637 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.34 -171.57 0.95 Allowed 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.669 1.352 . . . . 0.0 110.515 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.29 -44.03 2.8 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -77.48 -38.46 49.11 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.201 -1.176 . . . . 0.0 110.386 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 57.0 m -63.48 -38.1 89.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.11 -0.994 . . . . 0.0 110.331 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.84 -41.79 67.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.257 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 73.2 mt -69.65 -43.99 71.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 110.29 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.673 HD21 ' HD2' ' A' ' 18' ' ' TYR . 92.1 mt -67.87 -51.36 49.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -50.68 -34.46 26.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.157 -0.964 . . . . 0.0 110.005 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' B' ' 21' ' ' GLU . . . -59.64 -58.5 13.95 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.687 ' HD2' HD21 ' A' ' 15' ' ' LEU . 1.3 t80 -47.76 -44.55 28.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -1.016 . . . . 0.0 110.602 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -50.6 -55.7 15.13 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.047 -1.033 . . . . 0.0 108.878 179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.5 t -63.82 -44.38 98.15 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.416 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.0 OUTLIER -52.49 -69.01 0.12 Allowed 'General case' 0 C--N 1.303 -1.413 0 CA-C-O 121.374 0.607 . . . . 0.0 110.734 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 39.8 t -52.52 -22.73 3.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 O-C-N 121.38 -0.825 . . . . 0.0 110.498 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.9 mt -82.8 -21.47 34.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.109 -0.995 . . . . 0.0 110.059 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.28 -56.43 2.31 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.283 -0.886 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -57.27 -43.68 83.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.254 -0.904 . . . . 0.0 110.158 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.457 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.0 OUTLIER 52.84 52.6 10.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.378 -0.826 . . . . 0.0 110.163 -179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 44.3 Cg_endo -71.05 156.14 60.43 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.639 1.337 . . . . 0.0 110.489 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.38 -29.63 16.56 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.667 1.351 . . . . 0.0 110.094 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -124.76 119.43 28.88 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.365 -0.834 . . . . 0.0 110.109 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.5 -42.03 23.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.239 -0.913 . . . . 0.0 110.254 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.425 HG12 ' HG2' ' A' ' 42' ' ' ARG . 41.1 t -50.66 -59.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.931 . . . . 0.0 110.051 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -62.05 -35.98 80.25 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.59 -0.694 . . . . 0.0 109.971 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 53.2 t80 -65.52 -43.85 88.76 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.309 -0.87 . . . . 0.0 109.656 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.417 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.59 -36.07 71.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.372 -0.83 . . . . 0.0 110.097 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.488 HG13 ' OG1' ' A' ' 39' ' ' THR . 92.4 t -78.02 -44.68 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 O-C-N 121.202 -0.936 . . . . 0.0 110.154 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -59.69 -30.64 68.92 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.331 -0.856 . . . . 0.0 110.573 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.407 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 74.0 t80 -76.35 -58.32 3.35 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.129 -0.982 . . . . 0.0 110.367 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -65.58 -42.52 91.65 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.597 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.541 ' OG1' HG13 ' A' ' 35' ' ' VAL . 53.5 m -55.24 -44.72 75.77 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.003 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -61.96 -32.11 72.51 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.02 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -28.39 68.91 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.277 -0.89 . . . . 0.0 109.968 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.558 ' HG2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -68.63 -30.09 68.73 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.286 -0.884 . . . . 0.0 110.195 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.29 -33.83 75.05 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.918 . . . . 0.0 110.086 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -53.03 -64.14 0.92 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.897 . . . . 0.0 110.273 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.1 160.66 0.19 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.492 -0.755 . . . . 0.0 110.514 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.183 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.247 0.546 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttt -152.4 34.23 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.32 -0.862 . . . . 0.0 110.146 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.81 64.21 0.32 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -151.14 157.2 42.41 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.561 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.2 tp -100.26 60.1 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.277 -0.889 . . . . 0.0 110.153 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.411 ' C ' HD12 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -107.89 -171.48 1.88 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.266 -0.896 . . . . 0.0 110.234 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.607 ' N ' HD12 ' A' ' 7' ' ' ILE . 1.8 mp -93.51 138.35 23.0 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 109.536 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.02 151.08 55.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.689 1.363 . . . . 0.0 110.715 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.11 173.96 12.1 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.785 1.413 . . . . 0.0 110.345 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.46 -41.07 2.53 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -73.76 -28.44 61.68 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.314 -1.109 . . . . 0.0 110.184 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.5 m -71.64 -43.67 65.71 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 110.079 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.9 -36.66 62.94 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.301 -0.875 . . . . 0.0 110.435 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.5 tp -70.83 -50.39 35.98 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.267 -0.895 . . . . 0.0 110.404 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.68 -49.14 72.11 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.19 -0.944 . . . . 0.0 110.136 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.97 -34.71 60.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.145 -0.972 . . . . 0.0 109.772 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.96 -52.8 46.6 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 108.705 -1.758 . . . . 0.0 108.705 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.588 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -47.67 -37.9 13.87 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.492 -1.005 . . . . 0.0 110.149 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 m -65.77 -33.05 74.96 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.585 -0.697 . . . . 0.0 110.335 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.8 t -81.3 -27.28 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.289 -0.882 . . . . 0.0 110.687 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -80.79 -56.9 3.82 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.055 -1.028 . . . . 0.0 109.378 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 30' ' ' LEU . 25.8 t -56.7 -31.91 36.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.763 -0.585 . . . . 0.0 110.294 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 47.8 tp -75.15 -30.76 60.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.897 . . . . 0.0 110.236 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.03 -51.71 4.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.205 -0.934 . . . . 0.0 110.484 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.6 -34.49 67.43 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.224 -0.922 . . . . 0.0 109.961 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.97 71.3 1.53 Allowed Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.267 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.83 169.74 20.48 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.652 1.343 . . . . 0.0 110.462 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.12 -37.98 7.59 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.734 1.386 . . . . 0.0 110.331 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 33' ' ' PHE . 2.6 t70 -145.37 148.14 33.05 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.264 -0.898 . . . . 0.0 110.087 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.574 HD21 HG11 ' A' ' 22' ' ' VAL . 1.2 mt -83.71 -41.05 18.12 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.244 -0.91 . . . . 0.0 110.176 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.427 ' O ' HG23 ' A' ' 35' ' ' VAL . 41.2 t -52.13 -63.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.216 -0.928 . . . . 0.0 109.848 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.62 -39.66 85.0 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.539 -0.725 . . . . 0.0 109.882 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.423 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 34.1 t80 -62.83 -51.36 67.35 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.237 -0.914 . . . . 0.0 109.783 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.588 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -55.28 -33.88 63.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.387 -0.821 . . . . 0.0 110.004 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.499 HG13 ' OG1' ' B' ' 39' ' ' THR . 68.9 t -75.4 -50.51 23.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.359 0 O-C-N 121.32 -0.862 . . . . 0.0 110.198 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.46 -28.8 70.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.211 -0.93 . . . . 0.0 110.485 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -77.76 -63.08 1.47 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.219 -0.925 . . . . 0.0 110.471 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -58.6 -43.66 89.62 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.23 -0.919 . . . . 0.0 110.506 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.489 ' OG1' HG13 ' B' ' 35' ' ' VAL . 65.3 m -57.76 -46.24 84.79 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.335 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.04 -21.62 61.51 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.284 -0.885 . . . . 0.0 110.389 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.489 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -77.29 -20.3 55.24 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.381 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.33 -23.0 43.74 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.227 -0.92 . . . . 0.0 109.758 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.6 -19.47 52.66 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.253 -0.904 . . . . 0.0 110.098 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.44 -57.43 2.92 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 110.398 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -47.89 -28.13 2.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.604 -0.685 . . . . 0.0 110.888 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.19 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.233 0.54 . . . . 0.0 110.14 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttt -152.33 34.13 0.51 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.273 -0.892 . . . . 0.0 110.175 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.68 64.23 0.33 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -151.27 157.2 42.25 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -1.164 . . . . 0.0 110.175 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.54 ' O ' HG23 ' B' ' 5' ' ' ILE . 1.2 tp -100.22 59.97 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.314 -0.866 . . . . 0.0 110.254 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . 0.424 ' C ' HD12 ' B' ' 7' ' ' ILE . 0.0 OUTLIER -107.71 -171.21 1.83 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.208 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.626 HD12 ' N ' ' B' ' 7' ' ' ILE . 1.8 mp -93.81 138.35 22.81 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.195 -0.941 . . . . 0.0 109.495 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.92 151.09 56.2 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.64 1.337 . . . . 0.0 110.651 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.12 174.05 11.97 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.7 1.369 . . . . 0.0 110.397 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.32 -40.72 2.61 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tp -74.14 -28.39 61.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -1.135 . . . . 0.0 110.136 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.7 m -71.67 -43.69 65.6 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.257 -0.902 . . . . 0.0 110.125 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -53.83 -36.56 62.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.252 -0.905 . . . . 0.0 110.456 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 6.4 tp -70.83 -50.44 35.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.175 -0.953 . . . . 0.0 110.336 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 87.7 mt -64.71 -49.14 72.06 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -53.95 -34.94 61.11 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.066 -1.022 . . . . 0.0 109.633 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.67 -53.01 44.5 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.582 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.4 t80 -47.61 -37.96 13.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.459 -1.024 . . . . 0.0 110.097 179.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 7.3 m -65.75 -32.93 74.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.584 -0.698 . . . . 0.0 110.401 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 55.8 t -81.3 -27.46 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 110.739 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -80.57 -57.16 3.71 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.216 -0.927 . . . . 0.0 109.43 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.554 HG11 HD21 ' B' ' 30' ' ' LEU . 26.1 t -56.45 -31.84 34.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.76 -0.588 . . . . 0.0 110.305 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 47.7 tp -75.31 -30.57 60.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.221 -0.924 . . . . 0.0 110.334 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.18 -51.65 4.33 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.227 -0.921 . . . . 0.0 110.486 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.71 -34.64 67.25 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.27 -0.894 . . . . 0.0 109.797 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.21 71.15 1.56 Allowed Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.283 -0.885 . . . . 0.0 110.304 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.79 169.82 20.23 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 O-C-N 123.591 1.311 . . . . 0.0 110.466 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.18 -37.78 7.71 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.691 1.364 . . . . 0.0 110.315 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -145.61 148.05 32.7 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.246 -0.909 . . . . 0.0 110.084 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.554 HD21 HG11 ' B' ' 22' ' ' VAL . 1.1 mt -83.59 -41.28 18.03 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.415 ' O ' HG23 ' B' ' 35' ' ' VAL . 41.0 t -51.88 -63.36 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.916 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -59.68 -39.63 85.15 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.531 -0.731 . . . . 0.0 109.893 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.424 ' CD2' ' CE1' ' B' ' 18' ' ' TYR . 34.2 t80 -62.84 -51.11 68.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.795 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.582 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -55.53 -33.89 64.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 109.959 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.489 HG13 ' OG1' ' A' ' 39' ' ' THR . 70.3 t -75.41 -50.42 24.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.252 -0.905 . . . . 0.0 110.124 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.6 -28.78 70.13 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.253 -0.904 . . . . 0.0 110.445 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -77.57 -63.37 1.39 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.224 -0.922 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -58.38 -43.83 88.63 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.503 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.499 ' OG1' HG13 ' A' ' 35' ' ' VAL . 64.5 m -57.55 -46.2 84.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.195 -0.941 . . . . 0.0 110.359 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.14 -21.54 61.44 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.201 -0.937 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.498 ' O ' HD23 ' B' ' 41' ' ' LEU . 0.9 OUTLIER -77.52 -20.11 54.75 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.348 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.48 -22.78 43.62 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.225 -0.922 . . . . 0.0 109.763 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.69 -19.54 52.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.262 -0.899 . . . . 0.0 110.17 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -88.37 -57.33 2.96 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.19 -0.944 . . . . 0.0 110.396 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -48.11 -27.9 2.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.534 -0.729 . . . . 0.0 110.869 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.087 -0.958 . . . . 0.0 110.197 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.9 t60 . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.288 0.566 . . . . 0.0 110.08 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.66 -43.89 0.75 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 110.344 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 153.02 170.75 19.65 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -148.42 85.23 1.51 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -1.131 . . . . 0.0 110.236 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 5' ' ' ILE . 0.9 OUTLIER -112.46 62.36 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.886 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -109.23 41.14 1.69 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 110.243 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.8 mm -129.54 84.57 61.29 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 0.0 110.084 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -72.05 114.32 3.94 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.781 1.411 . . . . 0.0 110.456 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.66 162.79 40.32 Favored 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 123.598 1.315 . . . . 0.0 110.453 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.47 -29.52 9.53 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.476 HD11 HG11 ' B' ' 22' ' ' VAL . 1.0 OUTLIER -63.78 -38.73 92.2 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.235 -1.156 . . . . 0.0 110.146 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 48.4 m -57.75 -56.38 22.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.55 -50.38 53.57 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.398 -0.814 . . . . 0.0 110.439 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.443 ' HA ' HD12 ' A' ' 14' ' ' LEU . 7.8 tp -54.54 -55.52 28.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.46 -51.78 67.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.229 -0.92 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.64 -30.41 31.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.003 -1.06 . . . . 0.0 109.648 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -58.47 -56.81 23.2 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 108.781 -1.728 . . . . 0.0 108.781 179.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.437 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t80 -47.65 -38.17 14.33 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.485 -1.009 . . . . 0.0 110.338 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 1.1 m -64.63 -34.18 77.66 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.43 -0.793 . . . . 0.0 109.844 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.7 t -82.34 -27.09 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.364 -0.835 . . . . 0.0 110.358 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.7 OUTLIER -82.84 -59.25 2.56 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.089 -1.007 . . . . 0.0 108.99 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.49 HG11 ' CD2' ' A' ' 30' ' ' LEU . 43.5 t -55.03 -32.01 26.37 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.827 -0.546 . . . . 0.0 110.522 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 19' ' ' THR . 0.9 OUTLIER -83.73 -22.47 31.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.81 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.74 -58.58 2.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.456 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.44 ' OE1' ' CZ ' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -82.92 -22.22 33.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.19 -0.944 . . . . 0.0 110.571 -179.623 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.8 77.42 0.44 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.106 -0.996 . . . . 0.0 110.004 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 22' ' ' VAL . 44.4 Cg_endo -70.52 153.78 65.18 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.672 1.354 . . . . 0.0 110.574 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.82 -28.14 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.701 1.369 . . . . 0.0 110.441 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.96 125.28 12.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.347 -0.845 . . . . 0.0 110.15 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.49 ' CD2' HG11 ' A' ' 22' ' ' VAL . 1.2 mp -76.82 -31.38 56.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.292 -0.88 . . . . 0.0 109.989 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.866 HG12 ' HG2' ' B' ' 42' ' ' ARG . 44.8 t -54.3 -61.17 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 109.859 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.24 -45.69 83.61 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.964 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' OE1' ' A' ' 25' ' ' GLN . 49.4 t80 -58.15 -47.4 83.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 109.87 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.52 -34.98 52.25 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.373 -0.83 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' B' ' 39' ' ' THR . 94.0 t -80.85 -52.46 14.17 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 O-C-N 121.19 -0.944 . . . . 0.0 110.14 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.85 -40.31 66.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.314 -0.866 . . . . 0.0 110.554 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -70.38 -68.22 0.44 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.133 -0.979 . . . . 0.0 110.347 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.4 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 6.3 m-85 -50.47 -42.42 54.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.549 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.457 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.4 m -58.7 -35.72 73.09 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.103 -0.998 . . . . 0.0 109.855 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.44 -42.22 87.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.292 -0.88 . . . . 0.0 109.952 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.424 ' HA ' HD23 ' A' ' 41' ' ' LEU . 20.1 mt -59.21 -35.55 73.81 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.287 -0.883 . . . . 0.0 109.982 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.708 ' HG2' HG12 ' B' ' 31' ' ' VAL . 3.7 mmm-85 -56.13 -38.42 70.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.43 -0.794 . . . . 0.0 110.066 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -15.09 61.66 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.313 -0.867 . . . . 0.0 110.546 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -90.09 -63.21 1.31 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.057 -1.027 . . . . 0.0 110.497 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -47.79 136.42 10.82 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.517 -0.74 . . . . 0.0 110.886 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.189 -179.876 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 33.0 t60 . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.237 0.541 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -134.88 -43.98 0.73 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.281 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 153.06 170.87 19.81 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 67.8 m-70 -148.43 85.34 1.51 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.601 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.9 OUTLIER -112.56 62.25 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.137 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . 0.401 ' O ' HD13 ' B' ' 7' ' ' ILE . 20.4 mt-30 -109.17 41.12 1.69 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 110.259 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.401 HD13 ' O ' ' B' ' 6' ' ' GLN . 46.6 mm -129.42 84.46 61.96 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 110.105 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.86 114.41 3.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.666 1.35 . . . . 0.0 110.535 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.78 162.64 40.63 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.534 1.281 . . . . 0.0 110.43 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.68 -29.58 9.58 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.44 HD11 HG11 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -63.84 -38.59 91.65 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.272 -1.134 . . . . 0.0 110.151 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 47.5 m -57.67 -56.7 18.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.299 -0.876 . . . . 0.0 110.156 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.3 -50.56 50.18 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.336 -0.852 . . . . 0.0 110.418 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.44 ' HA ' HD12 ' B' ' 14' ' ' LEU . 7.8 tp -54.59 -55.35 30.26 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.878 . . . . 0.0 110.311 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.54 -51.81 67.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.269 -0.894 . . . . 0.0 110.264 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.61 -30.57 32.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.112 -0.992 . . . . 0.0 109.654 179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -58.27 -56.77 23.4 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 108.806 -1.717 . . . . 0.0 108.806 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.437 ' O ' HG23 ' B' ' 22' ' ' VAL . 1.1 t80 -47.81 -38.04 14.97 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.365 -1.079 . . . . 0.0 110.322 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' B' ' 23' ' ' LEU . 1.0 OUTLIER -64.77 -33.88 77.03 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.389 -0.819 . . . . 0.0 109.838 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.63 -26.91 8.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.34 -0.85 . . . . 0.0 110.415 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.7 OUTLIER -83.0 -59.37 2.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.182 -0.948 . . . . 0.0 108.897 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.49 HG11 ' CD2' ' B' ' 30' ' ' LEU . 43.8 t -54.91 -32.16 26.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 O-C-N 121.83 -0.543 . . . . 0.0 110.528 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' B' ' 19' ' ' THR . 0.9 OUTLIER -83.51 -22.58 32.44 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.089 -1.007 . . . . 0.0 110.363 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -86.61 -58.6 2.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.197 -0.939 . . . . 0.0 110.391 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.431 ' OE1' ' CZ ' ' B' ' 33' ' ' PHE . 0.0 OUTLIER -82.98 -22.29 33.73 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.59 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.89 77.44 0.44 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.117 -0.99 . . . . 0.0 109.971 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 22' ' ' VAL . 44.2 Cg_endo -70.66 153.83 64.54 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.717 1.377 . . . . 0.0 110.534 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.85 -28.16 20.34 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 O-C-N 123.838 1.441 . . . . 0.0 110.443 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -146.98 125.14 12.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.169 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.49 ' CD2' HG11 ' B' ' 22' ' ' VAL . 1.2 mp -76.68 -31.39 57.24 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.878 . . . . 0.0 110.025 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.708 HG12 ' HG2' ' A' ' 42' ' ' ARG . 43.9 t -54.22 -61.3 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.303 -0.873 . . . . 0.0 109.789 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -65.21 -45.45 84.66 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.543 -0.723 . . . . 0.0 109.999 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.431 ' CZ ' ' OE1' ' B' ' 25' ' ' GLN . 49.4 t80 -58.41 -47.41 84.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.227 -0.921 . . . . 0.0 109.849 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.38 -35.05 50.57 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.361 -0.837 . . . . 0.0 110.23 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.457 HG13 ' OG1' ' A' ' 39' ' ' THR . 94.8 t -80.79 -52.64 13.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.199 -0.938 . . . . 0.0 110.143 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -53.64 -40.41 65.82 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.309 -0.869 . . . . 0.0 110.566 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -70.23 -68.41 0.42 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.071 -1.018 . . . . 0.0 110.294 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -50.47 -42.31 54.21 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' A' ' 35' ' ' VAL . 54.9 m -58.61 -35.86 73.12 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.143 -0.973 . . . . 0.0 109.907 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.32 -42.26 88.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.29 -0.881 . . . . 0.0 109.945 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' B' ' 41' ' ' LEU . 20.2 mt -59.26 -35.45 73.74 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.302 -0.874 . . . . 0.0 109.953 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.866 ' HG2' HG12 ' A' ' 31' ' ' VAL . 3.7 mmm-85 -56.14 -38.5 70.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.321 -0.862 . . . . 0.0 110.134 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.77 -15.18 61.65 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.326 -0.859 . . . . 0.0 110.484 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -89.95 -63.3 1.3 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.086 -1.009 . . . . 0.0 110.512 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -47.67 136.57 10.3 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.575 -0.703 . . . . 0.0 110.802 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.315 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.7 m80 . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.287 0.565 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 mtt -99.0 108.17 20.78 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.257 -0.902 . . . . 0.0 110.134 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.4 -164.04 29.87 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -147.55 140.26 24.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.256 -1.143 . . . . 0.0 110.182 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 47.3 mm -101.75 154.49 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.85 177.98 6.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.201 -0.937 . . . . 0.0 110.302 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.5 mm -74.84 136.19 73.86 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.299 -0.876 . . . . 0.0 109.835 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.42 137.95 31.76 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.527 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.43 167.45 26.96 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.61 1.321 . . . . 0.0 110.388 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.35 -38.82 2.98 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -75.09 -19.34 60.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.215 -1.168 . . . . 0.0 110.325 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.7 m -69.96 -54.85 11.47 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.216 -0.928 . . . . 0.0 110.341 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -54.22 -37.12 64.23 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.287 -0.883 . . . . 0.0 110.327 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 14' ' ' LEU . 16.5 mt -63.06 -59.35 4.91 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.197 -0.939 . . . . 0.0 110.289 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.31 -48.81 80.22 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.255 -0.903 . . . . 0.0 110.353 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.32 -38.64 63.38 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.188 -0.945 . . . . 0.0 109.92 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.83 -52.8 48.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 108.758 -1.737 . . . . 0.0 108.758 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.33 -47.74 36.7 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.388 -1.066 . . . . 0.0 110.094 179.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.8 -40.93 56.65 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.387 -0.821 . . . . 0.0 110.471 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.4 t -76.97 -25.29 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.219 -0.926 . . . . 0.0 110.822 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -86.3 -59.08 2.39 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.07 -1.019 . . . . 0.0 109.241 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.41 ' H ' HG23 ' A' ' 22' ' ' VAL . 44.1 t -52.31 -26.71 9.45 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 O-C-N 121.654 -0.654 . . . . 0.0 110.238 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.3 tp -85.41 -38.13 19.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.093 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -53.52 5.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.205 -0.935 . . . . 0.0 110.082 179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -61.64 -41.38 97.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 110.104 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 50.03 56.24 17.45 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.337 -0.852 . . . . 0.0 110.375 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.39 155.81 59.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.623 1.328 . . . . 0.0 110.419 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -71.5 -21.53 25.88 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 O-C-N 123.706 1.372 . . . . 0.0 110.524 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.67 119.48 15.2 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.281 -0.887 . . . . 0.0 110.321 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.96 -30.23 35.21 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.337 -0.852 . . . . 0.0 110.237 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.2 t -51.51 -66.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.187 -0.946 . . . . 0.0 110.063 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.404 ' OD1' ' NH1' ' B' ' 42' ' ' ARG . 1.1 t70 -55.39 -42.76 74.45 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.363 -0.835 . . . . 0.0 109.971 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -58.31 -50.25 74.3 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.225 -0.922 . . . . 0.0 109.826 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.15 -40.55 64.37 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.352 -0.843 . . . . 0.0 110.366 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.552 HG13 ' OG1' ' B' ' 39' ' ' THR . 91.6 t -74.04 -46.12 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.179 -0.951 . . . . 0.0 110.26 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.44 -24.22 67.55 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.2 -0.937 . . . . 0.0 110.287 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -73.36 -68.13 0.52 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.233 -0.917 . . . . 0.0 110.391 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.427 ' HB3' HG23 ' B' ' 35' ' ' VAL . 29.9 m-85 -59.33 -50.78 72.67 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.944 . . . . 0.0 110.389 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.56 ' OG1' HG13 ' B' ' 35' ' ' VAL . 97.8 m -49.97 -33.77 18.81 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.12 -0.988 . . . . 0.0 110.235 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -75.39 -25.28 57.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.244 -0.91 . . . . 0.0 109.739 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -38.28 90.2 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.376 -0.827 . . . . 0.0 109.739 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' NH1' ' OD1' ' B' ' 32' ' ' ASP . 0.0 OUTLIER -50.54 -40.01 50.7 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 179.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -76.48 -25.29 54.13 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.329 -0.857 . . . . 0.0 110.121 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.12 -67.37 0.58 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.245 -0.909 . . . . 0.0 110.19 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -50.88 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.556 -0.715 . . . . 0.0 110.526 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 mtp180 . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.98 -1.01 . . . . 0.0 110.177 179.756 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 2.8 m80 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.248 0.547 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.7 mtt -98.8 107.94 20.5 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.855 . . . . 0.0 110.178 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -80.06 -164.31 29.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -147.46 140.18 24.83 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.299 -1.118 . . . . 0.0 110.163 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 47.2 mm -101.74 154.49 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.253 -0.904 . . . . 0.0 110.143 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.83 178.04 6.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.189 -0.944 . . . . 0.0 110.285 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -74.83 136.28 73.86 Favored Pre-proline 0 N--CA 1.491 1.625 0 O-C-N 121.229 -0.919 . . . . 0.0 109.888 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.5 137.88 31.38 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.532 1.28 . . . . 0.0 110.417 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.43 167.52 26.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.632 1.333 . . . . 0.0 110.51 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.29 -38.84 2.96 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 tt -74.97 -19.69 59.99 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -1.144 . . . . 0.0 110.301 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 74.9 m -69.56 -54.87 12.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 110.37 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.29 -37.07 64.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.369 -0.832 . . . . 0.0 110.332 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 14' ' ' LEU . 16.6 mt -63.01 -59.57 4.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.291 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 8.0 mp -59.2 -48.66 80.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.249 -0.907 . . . . 0.0 110.283 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -53.36 -38.88 63.71 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.019 -1.05 . . . . 0.0 109.916 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.42 -53.15 45.35 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 108.86 -1.696 . . . . 0.0 108.86 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -48.12 -47.68 34.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.405 -1.056 . . . . 0.0 110.146 179.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.8 m -50.9 -40.82 57.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.518 -0.739 . . . . 0.0 110.513 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -77.14 -25.2 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.185 -0.947 . . . . 0.0 110.676 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.6 OUTLIER -86.42 -58.86 2.46 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.105 -0.997 . . . . 0.0 109.265 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 44.4 t -52.51 -26.64 10.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 121.729 -0.607 . . . . 0.0 110.214 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -85.47 -38.17 18.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.26 -0.9 . . . . 0.0 110.056 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.82 -53.53 5.81 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.177 -0.952 . . . . 0.0 110.023 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.9 mm100 -61.6 -41.63 97.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 109.991 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 50.27 56.19 17.29 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.367 -0.833 . . . . 0.0 110.346 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.48 155.9 58.97 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 O-C-N 123.713 1.375 . . . . 0.0 110.459 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.46 -21.51 26.01 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 O-C-N 123.721 1.379 . . . . 0.0 110.6 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -137.7 119.35 15.02 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.179 -0.951 . . . . 0.0 110.305 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tp -80.93 -30.15 35.37 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.147 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -51.58 -65.99 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . 0.406 ' OD1' ' NH1' ' A' ' 42' ' ' ARG . 1.1 t70 -55.35 -42.94 74.53 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.444 -0.785 . . . . 0.0 109.941 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -58.13 -50.36 73.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.242 -0.911 . . . . 0.0 109.897 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -53.24 -40.29 64.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.396 -0.815 . . . . 0.0 110.426 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.56 HG13 ' OG1' ' A' ' 39' ' ' THR . 93.3 t -74.08 -46.23 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.35 -24.27 67.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.172 -0.955 . . . . 0.0 110.294 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -73.29 -67.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 110.427 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.42 ' HB3' HG23 ' A' ' 35' ' ' VAL . 29.2 m-85 -59.68 -50.46 73.78 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.267 -0.895 . . . . 0.0 110.443 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.552 ' OG1' HG13 ' A' ' 35' ' ' VAL . 98.8 m -50.15 -33.83 20.34 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.074 -1.016 . . . . 0.0 110.205 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -75.27 -25.27 57.88 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.219 -0.925 . . . . 0.0 109.79 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.85 -38.01 89.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.327 -0.858 . . . . 0.0 109.803 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.404 ' NH1' ' OD1' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -50.88 -39.9 55.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.362 -0.836 . . . . 0.0 110.155 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -76.54 -25.19 53.84 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.35 -0.843 . . . . 0.0 110.234 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.13 -67.22 0.59 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.251 -0.906 . . . . 0.0 110.259 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -51.0 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.473 -0.767 . . . . 0.0 110.423 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.13 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.0 m-70 . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.281 0.562 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 38.9 ttm -81.63 -27.22 34.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.94 -149.62 6.07 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.2 p-80 -155.85 37.2 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.243 -1.151 . . . . 0.0 110.186 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.416 ' O ' HG23 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -113.14 134.01 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.327 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.33 53.48 0.55 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.268 -0.895 . . . . 0.0 110.175 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -122.94 94.86 46.91 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.151 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.17 139.38 29.37 Favored 'Trans proline' 0 C--N 1.311 -1.423 0 O-C-N 123.569 1.299 . . . . 0.0 110.407 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -73.84 -169.63 0.58 Allowed 'Trans proline' 0 C--N 1.312 -1.381 0 O-C-N 123.528 1.278 . . . . 0.0 110.524 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.53 -43.74 1.77 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.788 ' O ' HD23 ' A' ' 11' ' ' LEU . 2.9 tt -73.36 -27.26 61.4 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.191 -1.182 . . . . 0.0 110.29 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 41.2 m -65.22 -47.29 77.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.238 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -57.63 -33.81 68.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 -58.78 4.27 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 110.102 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 73.4 mt -56.55 -41.58 77.11 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.213 -0.929 . . . . 0.0 109.774 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -41.06 59.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.185 -0.947 . . . . 0.0 109.779 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 21' ' ' GLU . . . -56.61 -61.35 7.58 Favored Glycine 0 N--CA 1.488 2.106 0 N-CA-C 108.603 -1.799 . . . . 0.0 108.603 179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.652 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 2.2 t80 -48.64 -47.73 40.16 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.459 -1.024 . . . . 0.0 110.506 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.1 -54.41 25.24 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.092 -1.005 . . . . 0.0 108.879 179.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.29 -44.86 99.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -51.27 -65.07 0.62 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-O 121.478 0.656 . . . . 0.0 110.685 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 18' ' ' TYR . 21.1 t -54.95 -29.29 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.591 -0.693 . . . . 0.0 110.341 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.406 ' HA ' HD13 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -72.71 -25.57 61.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.087 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.42 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -104.49 -50.47 3.31 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.227 -0.921 . . . . 0.0 109.996 179.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 27' ' ' PRO . 0.2 OUTLIER -86.34 50.85 2.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.326 -0.859 . . . . 0.0 110.452 -179.893 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.35 96.09 0.11 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.826 -0.546 . . . . 0.0 111.121 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.414 ' CD ' ' O ' ' A' ' 25' ' ' GLN . 48.2 Cg_endo -89.92 153.42 4.93 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 124.004 1.529 . . . . 0.0 110.804 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.06 -27.93 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.694 1.365 . . . . 0.0 109.812 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.44 115.8 11.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.488 -0.758 . . . . 0.0 109.839 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.72 -38.26 83.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.261 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.8 t -53.6 -65.72 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.174 -0.954 . . . . 0.0 109.866 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -56.98 -34.73 68.4 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.359 -0.838 . . . . 0.0 109.964 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.471 ' HD2' ' HH ' ' A' ' 18' ' ' TYR . 64.9 t80 -66.75 -44.32 81.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 0.0 109.675 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.652 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -62.55 -30.56 71.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.314 -0.866 . . . . 0.0 109.958 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.402 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.8 t -76.55 -48.41 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.337 -0.852 . . . . 0.0 110.165 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.18 -26.3 64.68 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.18 -0.95 . . . . 0.0 110.477 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -78.25 -68.47 0.64 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.127 -0.983 . . . . 0.0 110.525 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -56.93 -45.3 82.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.237 -0.915 . . . . 0.0 110.528 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.42 ' OG1' HG13 ' B' ' 35' ' ' VAL . 99.7 m -53.55 -43.98 68.86 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.082 -1.011 . . . . 0.0 110.024 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -66.12 -32.08 73.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.323 -0.861 . . . . 0.0 110.116 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -64.9 -40.07 94.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.025 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -39.42 90.16 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.272 -0.892 . . . . 0.0 110.219 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -76.72 -21.98 54.52 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.336 -0.852 . . . . 0.0 110.296 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.3 -65.79 0.64 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.233 -0.917 . . . . 0.0 110.335 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -48.82 129.19 16.74 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.462 -0.774 . . . . 0.0 110.719 -179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.291 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 30.8 m-70 . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.283 0.564 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 38.7 ttm -81.74 -27.18 33.99 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.905 . . . . 0.0 110.17 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.92 -149.58 6.05 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 37.7 p-80 -155.89 36.98 0.35 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -1.147 . . . . 0.0 110.101 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.428 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.9 OUTLIER -112.81 133.97 56.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.862 . . . . 0.0 110.433 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -156.35 53.43 0.55 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.303 -0.873 . . . . 0.0 110.287 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -122.83 94.81 47.07 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.268 -0.895 . . . . 0.0 110.206 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.16 139.32 29.32 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.662 1.348 . . . . 0.0 110.336 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.87 -169.53 0.57 Allowed 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.575 1.303 . . . . 0.0 110.478 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.34 -43.55 1.81 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.788 ' O ' HD23 ' B' ' 11' ' ' LEU . 2.9 tt -73.34 -27.28 61.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.229 -1.16 . . . . 0.0 110.299 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 39.9 m -65.22 -47.38 77.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.281 -0.887 . . . . 0.0 110.267 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -57.55 -33.93 68.63 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.191 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.86 -59.04 3.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 110.08 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 75.3 mt -56.28 -41.68 76.26 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.212 -0.93 . . . . 0.0 109.801 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -40.93 59.74 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.077 -1.014 . . . . 0.0 109.891 179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' B' ' 21' ' ' GLU . . . -56.55 -61.47 7.44 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.649 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 2.2 t80 -48.63 -47.83 39.93 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.392 -1.064 . . . . 0.0 110.517 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -51.02 -54.5 24.02 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.147 -0.971 . . . . 0.0 108.886 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 2.8 t -61.19 -44.71 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 177.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.464 ' HB2' ' HA ' ' B' ' 18' ' ' TYR . 0.2 OUTLIER -51.43 -64.98 0.64 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.564 0.697 . . . . 0.0 110.707 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.494 HG23 ' O ' ' B' ' 18' ' ' TYR . 21.1 t -54.99 -29.39 21.88 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.424 -0.798 . . . . 0.0 110.296 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.58 -25.52 61.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.161 -0.962 . . . . 0.0 110.089 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.414 ' N ' ' HD2' ' B' ' 24' ' ' ARG . 0.0 OUTLIER -104.62 -50.55 3.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.957 179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.415 ' O ' ' N ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER -86.28 50.75 2.05 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.37 -0.831 . . . . 0.0 110.468 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.25 95.98 0.1 Allowed Pre-proline 0 N--CA 1.503 2.18 0 O-C-N 121.83 -0.543 . . . . 0.0 111.14 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.415 ' N ' ' O ' ' B' ' 25' ' ' GLN . 48.3 Cg_endo -89.86 153.48 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 124.014 1.534 . . . . 0.0 110.803 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.04 -28.12 19.58 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.733 1.386 . . . . 0.0 109.88 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -137.21 115.85 12.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.433 -0.792 . . . . 0.0 109.778 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.66 -38.34 83.64 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.27 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.4 t -53.63 -65.6 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.166 -0.959 . . . . 0.0 109.929 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.08 -34.58 68.45 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.507 -0.745 . . . . 0.0 109.983 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.457 ' HD2' ' HH ' ' B' ' 18' ' ' TYR . 65.5 t80 -66.98 -43.85 81.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.649 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -62.89 -30.54 71.61 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.32 -0.862 . . . . 0.0 109.948 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.42 HG13 ' OG1' ' A' ' 39' ' ' THR . 87.8 t -76.43 -48.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 121.368 -0.833 . . . . 0.0 110.178 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -59.11 -26.4 64.66 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 110.473 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -78.12 -68.17 0.66 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.588 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -57.29 -45.43 84.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.206 -0.933 . . . . 0.0 110.426 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.409 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 99.7 m -53.43 -43.85 68.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.099 -1.001 . . . . 0.0 110.079 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -66.23 -31.98 73.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.091 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -65.03 -39.86 94.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.251 -0.906 . . . . 0.0 110.038 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -39.51 90.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.275 -0.89 . . . . 0.0 110.151 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -76.66 -21.9 54.78 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.281 -0.887 . . . . 0.0 110.265 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.4 -65.52 0.68 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.247 -0.908 . . . . 0.0 110.37 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.15 129.25 17.72 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.514 -0.741 . . . . 0.0 110.657 -179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 118.072 -0.966 . . . . 0.0 110.148 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 m80 . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.299 0.571 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.9 ptm -141.93 20.54 2.13 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.171 -0.955 . . . . 0.0 110.349 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.11 145.87 12.14 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.4 m80 -128.1 159.43 35.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.184 -1.186 . . . . 0.0 110.307 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.637 ' N ' HD12 ' A' ' 5' ' ' ILE . 5.3 mp -113.69 95.51 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.205 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -148.1 171.07 16.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.279 -0.888 . . . . 0.0 110.303 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.3 117.49 68.85 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.03 147.05 48.22 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.484 1.255 . . . . 0.0 110.515 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.07 143.57 32.65 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 O-C-N 123.778 1.41 . . . . 0.0 110.537 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.51 -20.45 44.41 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 29.9 tp -70.11 -52.98 19.43 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.126 -1.22 . . . . 0.0 110.407 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 83.1 m -60.76 -49.95 75.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -0.877 . . . . 0.0 110.401 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.67 -45.57 66.84 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.324 -0.86 . . . . 0.0 110.407 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HA ' HD23 ' A' ' 14' ' ' LEU . 2.1 mt -56.08 -53.56 55.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.168 -0.957 . . . . 0.0 110.341 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.49 HD21 ' HD2' ' B' ' 18' ' ' TYR . 66.7 mt -62.73 -47.82 81.94 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.21 -0.931 . . . . 0.0 110.08 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.58 -34.55 58.75 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.236 -0.915 . . . . 0.0 109.719 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.77 -55.28 30.85 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 108.828 -1.709 . . . . 0.0 108.828 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.435 ' HD2' HD21 ' B' ' 15' ' ' LEU . 1.6 t80 -47.39 -43.66 23.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.504 -0.998 . . . . 0.0 110.404 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' HD12 ' A' ' 23' ' ' LEU . 2.4 m -55.9 -36.12 67.32 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.431 -0.793 . . . . 0.0 110.265 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.7 t -82.41 -25.35 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.185 -0.947 . . . . 0.0 110.543 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.8 mt-10 -85.32 -54.12 4.8 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.13 -0.981 . . . . 0.0 108.886 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.9 t -53.75 -39.15 37.74 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 CA-C-O 121.219 0.533 . . . . 0.0 110.308 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.508 HD12 ' O ' ' A' ' 19' ' ' THR . 12.1 mt -70.99 -40.4 71.88 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.273 -0.892 . . . . 0.0 110.211 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.22 -65.42 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.236 -0.915 . . . . 0.0 110.242 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.13 65.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.177 -0.952 . . . . 0.0 110.081 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.96 58.58 16.81 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.318 -0.864 . . . . 0.0 110.566 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.54 146.89 50.63 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.627 1.33 . . . . 0.0 110.303 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.66 -30.77 17.6 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.63 1.332 . . . . 0.0 110.536 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -133.6 121.21 21.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.248 -0.908 . . . . 0.0 110.241 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.5 -25.04 41.88 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.065 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.679 HG12 ' HD2' ' B' ' 42' ' ' ARG . 41.0 t -54.34 -53.71 27.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.211 -0.931 . . . . 0.0 109.793 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.38 -47.44 60.9 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.584 -0.697 . . . . 0.0 109.934 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -58.13 -50.51 73.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.224 -0.922 . . . . 0.0 109.577 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.464 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -53.78 -37.35 63.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.306 -0.871 . . . . 0.0 109.921 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.507 HG13 ' OG1' ' B' ' 39' ' ' THR . 68.8 t -79.31 -34.89 16.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.34 -0.85 . . . . 0.0 109.915 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.76 -22.75 49.76 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -79.76 -64.01 1.28 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.176 -0.952 . . . . 0.0 110.623 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.482 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 15.4 m-85 -59.43 -48.07 83.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.198 -0.939 . . . . 0.0 110.533 -179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.517 ' OG1' HG13 ' B' ' 35' ' ' VAL . 62.3 m -52.48 -50.57 62.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.041 -1.037 . . . . 0.0 110.052 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -58.79 -26.7 64.33 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.157 -0.965 . . . . 0.0 109.832 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.563 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 2.9 tp -61.63 -40.9 96.5 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.4 -0.813 . . . . 0.0 110.12 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.646 ' HD2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -52.55 -63.06 1.26 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.339 -0.85 . . . . 0.0 110.231 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -62.45 -19.97 64.05 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.907 . . . . 0.0 110.241 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 41' ' ' LEU . . . -66.7 -59.19 3.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.452 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.3 -39.38 21.58 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.473 -0.767 . . . . 0.0 110.926 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.231 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 m80 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.18 0.514 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 23.9 ptm -141.74 20.54 2.16 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.449 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.01 145.76 12.01 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 15.6 m80 -128.02 159.27 35.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.26 -1.141 . . . . 0.0 110.346 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.635 HD12 ' N ' ' B' ' 5' ' ' ILE . 5.3 mp -113.53 95.39 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -0.895 . . . . 0.0 110.206 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -147.89 171.29 15.99 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.168 -0.958 . . . . 0.0 110.284 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.43 117.4 68.63 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.204 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.95 147.2 48.97 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.5 1.263 . . . . 0.0 110.429 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.21 143.56 32.08 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.693 1.364 . . . . 0.0 110.503 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.65 -20.59 43.6 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 tp -70.16 -52.81 20.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.093 -1.24 . . . . 0.0 110.422 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 85.7 m -60.86 -49.83 75.88 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.167 -0.958 . . . . 0.0 110.308 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -52.79 -45.54 67.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.0 110.37 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 14' ' ' LEU . 2.1 mt -56.1 -53.73 53.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.211 -0.931 . . . . 0.0 110.294 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.435 HD21 ' HD2' ' A' ' 18' ' ' TYR . 66.4 mt -62.63 -47.89 81.77 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.242 -0.912 . . . . 0.0 110.022 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -53.55 -34.63 58.92 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.15 -0.969 . . . . 0.0 109.659 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.69 -55.29 30.74 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.85 -1.7 . . . . 0.0 108.85 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.49 ' HD2' HD21 ' A' ' 15' ' ' LEU . 1.6 t80 -47.43 -43.56 23.95 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.375 -1.074 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.512 ' O ' HD12 ' B' ' 23' ' ' LEU . 2.4 m -56.09 -35.92 67.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.531 -0.731 . . . . 0.0 110.254 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.46 -25.53 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.26 -0.9 . . . . 0.0 110.476 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.421 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 1.8 mt-10 -85.22 -54.06 4.85 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.129 -0.982 . . . . 0.0 108.877 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 95.6 t -53.82 -39.04 37.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.859 -0.526 . . . . 0.0 110.249 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.512 HD12 ' O ' ' B' ' 19' ' ' THR . 12.2 mt -71.1 -40.53 71.45 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.235 -0.915 . . . . 0.0 110.146 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.04 -65.48 0.83 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 110.266 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.26 -31.09 65.22 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.203 -0.936 . . . . 0.0 110.015 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 50.93 58.56 16.83 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.525 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.37 146.96 51.73 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.691 1.364 . . . . 0.0 110.339 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.71 -31.01 17.04 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.685 1.361 . . . . 0.0 110.52 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -133.43 121.34 22.12 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.274 -0.891 . . . . 0.0 110.21 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -79.52 -25.16 41.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 110.067 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.646 HG12 ' HD2' ' A' ' 42' ' ' ARG . 41.6 t -54.22 -53.73 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.234 -0.916 . . . . 0.0 109.768 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -70.42 -47.37 61.05 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.598 -0.689 . . . . 0.0 109.952 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -58.2 -50.33 73.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 109.619 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.482 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -53.87 -37.51 63.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.345 -0.847 . . . . 0.0 109.881 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.517 HG13 ' OG1' ' A' ' 39' ' ' THR . 72.2 t -79.13 -34.78 16.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 O-C-N 121.341 -0.85 . . . . 0.0 110.019 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -77.94 -22.64 49.23 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.314 -0.866 . . . . 0.0 109.669 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -79.75 -64.24 1.23 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.218 -0.926 . . . . 0.0 110.586 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.464 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 15.2 m-85 -59.21 -47.98 83.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.184 -0.947 . . . . 0.0 110.683 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.507 ' OG1' HG13 ' A' ' 35' ' ' VAL . 61.0 m -52.76 -50.37 63.64 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.956 -1.09 . . . . 0.0 110.051 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 mtt180 -59.0 -26.65 64.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.857 179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.574 ' O ' ' HB3' ' B' ' 44' ' ' ALA . 2.9 tp -61.67 -40.87 96.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 110.04 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.679 ' HD2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -52.45 -63.21 1.22 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.283 -0.886 . . . . 0.0 110.193 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -62.29 -20.15 64.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' B' ' 41' ' ' LEU . . . -66.51 -59.31 3.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.197 -0.939 . . . . 0.0 110.435 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.37 -39.23 21.55 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.517 -0.74 . . . . 0.0 110.906 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.253 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.7 p-80 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.194 0.521 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 14.3 ttp -73.68 108.65 6.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.257 -0.902 . . . . 0.0 110.178 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.97 165.47 16.83 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.12 176.32 7.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.304 -1.115 . . . . 0.0 110.261 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.693 ' N ' HD12 ' A' ' 5' ' ' ILE . 4.7 mp -109.14 110.33 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.235 -0.916 . . . . 0.0 110.251 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -113.85 83.95 1.95 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.868 . . . . 0.0 110.167 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.627 HD12 ' C ' ' A' ' 7' ' ' ILE . 2.3 pp -65.72 147.82 98.52 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.919 . . . . 0.0 110.183 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.01 119.25 6.06 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.732 1.385 . . . . 0.0 110.495 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.11 158.73 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.529 1.278 . . . . 0.0 110.362 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.17 -35.51 4.98 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.16 -29.16 70.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -1.164 . . . . 0.0 110.214 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.9 m -56.77 -45.73 81.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.259 -0.9 . . . . 0.0 110.123 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.48 -36.92 79.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -0.846 . . . . 0.0 110.366 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.33 -47.9 53.72 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.2 -0.938 . . . . 0.0 110.232 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.41 ' HA ' HD13 ' A' ' 15' ' ' LEU . 0.7 OUTLIER -65.36 -58.2 6.48 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.075 -1.015 . . . . 0.0 110.102 -179.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.4 -24.69 5.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.155 -0.966 . . . . 0.0 109.903 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -65.94 -57.41 10.89 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.6 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t80 -48.54 -35.8 14.07 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.384 -1.068 . . . . 0.0 110.312 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.01 -39.17 93.96 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.42 -0.8 . . . . 0.0 110.065 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.423 ' O ' ' CB ' ' A' ' 24' ' ' ARG . 92.2 t -80.88 -21.52 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 110.798 -179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.4 OUTLIER -86.95 -55.05 4.01 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.065 -1.022 . . . . 0.0 109.333 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 18' ' ' TYR . 29.0 t -56.85 -31.18 35.13 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.722 -0.611 . . . . 0.0 110.389 -179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.454 ' HA ' HD23 ' A' ' 23' ' ' LEU . 32.4 mt -87.43 -42.0 13.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.218 -0.926 . . . . 0.0 110.34 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.423 ' CB ' ' O ' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -71.9 -53.27 13.69 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.143 -0.973 . . . . 0.0 110.262 -179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.31 -35.35 63.66 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.191 -0.943 . . . . 0.0 109.855 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.3 64.07 8.97 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.276 -0.89 . . . . 0.0 110.476 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.39 151.29 65.38 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.741 1.39 . . . . 0.0 110.527 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.36 -22.52 25.05 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.733 1.386 . . . . 0.0 110.272 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.73 116.31 14.75 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.261 -0.9 . . . . 0.0 110.13 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.538 HD11 ' CE2' ' A' ' 18' ' ' TYR . 7.5 tp -80.53 -34.2 35.73 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 110.307 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.406 ' H ' HG23 ' A' ' 31' ' ' VAL . 48.4 t -51.67 -66.21 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.208 -0.932 . . . . 0.0 110.142 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.15 -40.5 67.49 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.428 -0.795 . . . . 0.0 109.804 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -60.9 -54.98 38.44 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.36 -0.838 . . . . 0.0 109.763 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.519 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -53.0 -38.55 62.4 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.575 HG13 ' OG1' ' B' ' 39' ' ' THR . 81.6 t -77.37 -27.09 15.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 O-C-N 121.293 -0.879 . . . . 0.0 109.837 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -81.99 -51.94 7.54 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.334 -0.854 . . . . 0.0 109.868 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -56.71 -63.17 1.29 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 110.786 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CG ' ' HB1' ' B' ' 34' ' ' ALA . 15.9 m-85 -53.89 -52.31 60.93 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 111.008 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.584 ' OG1' HG13 ' B' ' 35' ' ' VAL . 22.3 m -53.36 -24.93 13.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.933 -1.104 . . . . 0.0 110.086 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.09 -25.56 43.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.929 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.6 -25.35 60.29 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.255 -0.903 . . . . 0.0 109.966 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.04 -29.1 64.91 Favored 'General case' 0 C--N 1.305 -1.361 0 O-C-N 121.262 -0.899 . . . . 0.0 109.629 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -66.43 -35.28 79.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.32 -0.862 . . . . 0.0 110.184 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.11 -65.41 0.69 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.251 -0.906 . . . . 0.0 110.323 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -49.73 -71.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.611 -0.681 . . . . 0.0 110.686 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.293 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.234 0.54 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 14.1 ttp -73.71 108.46 6.57 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.209 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.74 165.5 16.53 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.25 176.23 7.84 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.239 -1.153 . . . . 0.0 110.279 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.682 HD12 ' N ' ' B' ' 5' ' ' ILE . 4.7 mp -109.05 110.26 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.303 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -113.73 83.75 1.91 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.209 -0.932 . . . . 0.0 110.21 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.638 ' C ' HD12 ' B' ' 7' ' ' ILE . 2.3 pp -65.69 147.87 98.48 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.204 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.02 119.28 6.08 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.705 1.371 . . . . 0.0 110.393 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.18 158.79 53.93 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.49 1.258 . . . . 0.0 110.38 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 107.19 -35.45 5.02 Favored Glycine 0 N--CA 1.489 2.17 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.1 -29.32 70.24 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -1.148 . . . . 0.0 110.212 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 93.9 m -56.66 -45.68 81.5 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.249 -0.907 . . . . 0.0 110.239 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -36.79 79.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.364 -0.835 . . . . 0.0 110.281 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.53 -47.79 52.9 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.273 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' B' ' 15' ' ' LEU . 0.7 OUTLIER -65.27 -58.2 6.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.19 -0.944 . . . . 0.0 110.214 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -51.52 -24.65 5.45 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.21 -0.931 . . . . 0.0 109.858 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -65.81 -57.61 10.67 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.598 ' O ' HG23 ' B' ' 22' ' ' VAL . 1.1 t80 -48.44 -35.85 13.69 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.423 -1.045 . . . . 0.0 110.394 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.9 m -63.02 -39.19 94.02 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.479 -0.763 . . . . 0.0 110.039 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.419 ' O ' ' CB ' ' B' ' 24' ' ' ARG . 92.9 t -80.76 -21.57 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.952 . . . . 0.0 110.825 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.4 OUTLIER -86.97 -55.14 3.96 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.014 -1.053 . . . . 0.0 109.269 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.598 HG23 ' O ' ' B' ' 18' ' ' TYR . 29.1 t -56.79 -31.07 34.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 O-C-N 121.716 -0.615 . . . . 0.0 110.475 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' B' ' 23' ' ' LEU . 32.0 mt -87.51 -42.14 12.98 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.082 -1.011 . . . . 0.0 110.29 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.419 ' CB ' ' O ' ' B' ' 20' ' ' VAL . 0.2 OUTLIER -71.88 -53.2 13.93 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 110.241 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -74.29 -35.4 63.72 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.202 -0.936 . . . . 0.0 109.763 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 50.28 64.14 8.86 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.323 -0.861 . . . . 0.0 110.441 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -70.56 151.32 64.42 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.675 1.355 . . . . 0.0 110.449 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -71.41 -22.36 25.08 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.714 1.376 . . . . 0.0 110.313 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -134.81 116.4 14.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 110.067 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.536 HD11 ' CE2' ' B' ' 18' ' ' TYR . 7.7 tp -80.67 -34.32 34.89 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.365 -0.835 . . . . 0.0 110.261 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.403 ' H ' HG23 ' B' ' 31' ' ' VAL . 48.5 t -51.59 -66.33 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.271 -0.893 . . . . 0.0 110.038 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.03 -40.57 67.19 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.543 -0.723 . . . . 0.0 109.831 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -60.79 -55.09 37.28 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.409 -0.807 . . . . 0.0 109.688 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.514 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.96 -38.25 61.89 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.395 -0.816 . . . . 0.0 109.997 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.584 HG13 ' OG1' ' A' ' 39' ' ' THR . 81.1 t -77.73 -26.76 15.06 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 O-C-N 121.248 -0.907 . . . . 0.0 109.838 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -82.3 -51.96 7.39 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.275 -0.891 . . . . 0.0 109.772 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -56.85 -63.01 1.35 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.3 -0.875 . . . . 0.0 110.715 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -54.15 -52.1 62.2 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.926 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.575 ' OG1' HG13 ' A' ' 35' ' ' VAL . 22.4 m -53.37 -25.2 14.49 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.08 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -25.91 43.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 109.84 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.14 -25.41 60.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.242 -0.911 . . . . 0.0 110.03 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -28.99 64.73 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.371 -0.83 . . . . 0.0 109.672 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -66.43 -35.23 79.79 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.199 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.3 -65.24 0.71 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.321 -0.862 . . . . 0.0 110.291 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -49.97 -71.22 0.07 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.481 -0.762 . . . . 0.0 110.492 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.098 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.6 ttt 53.11 76.73 0.19 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.311 -0.868 . . . . 0.0 110.217 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.82 105.78 0.2 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -128.02 -70.27 0.7 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.232 -1.158 . . . . 0.0 110.329 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.1 tp -112.58 142.53 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.264 -0.898 . . . . 0.0 110.386 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -167.42 60.78 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.403 -0.811 . . . . 0.0 110.103 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.631 HD12 ' C ' ' A' ' 7' ' ' ILE . 2.2 pp -126.9 158.0 69.93 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.933 . . . . 0.0 110.259 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.35 115.99 4.54 Favored 'Trans proline' 0 C--N 1.312 -1.374 0 O-C-N 123.82 1.432 . . . . 0.0 110.54 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.13 151.58 49.7 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.521 1.274 . . . . 0.0 110.319 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.03 -32.23 4.84 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.54 -27.1 60.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.257 -1.143 . . . . 0.0 110.239 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.09 -61.64 2.31 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.57 -48.37 57.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.349 -0.844 . . . . 0.0 110.371 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.68 -57.91 10.01 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.291 -0.88 . . . . 0.0 110.153 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -60.69 -38.55 85.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.241 -0.912 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -54.09 -42.85 69.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.091 -1.005 . . . . 0.0 109.754 179.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.417 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -56.49 -56.23 25.58 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.844 -1.702 . . . . 0.0 108.844 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.635 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -47.09 -45.86 22.31 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.467 -1.019 . . . . 0.0 110.423 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 42.0 m -61.22 -32.89 72.67 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.472 -0.767 . . . . 0.0 109.86 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.592 HG23 ' O ' ' A' ' 16' ' ' GLN . 48.0 t -82.72 -26.99 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.307 -0.871 . . . . 0.0 110.664 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -80.12 -59.21 2.8 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.089 -1.007 . . . . 0.0 109.016 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.47 HG11 HD21 ' B' ' 11' ' ' LEU . 20.7 t -54.93 -32.94 27.51 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.883 -0.511 . . . . 0.0 109.8 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.26 -19.86 42.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.082 -1.011 . . . . 0.0 110.215 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.15 -49.45 8.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -0.921 . . . . 0.0 110.504 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.437 ' CG ' ' HD3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -99.99 -23.59 14.87 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.22 -0.925 . . . . 0.0 110.678 -179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 49.67 71.04 1.7 Allowed Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.437 ' HD3' ' CG ' ' A' ' 25' ' ' GLN . 44.6 Cg_endo -71.2 154.09 61.96 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.679 1.357 . . . . 0.0 110.379 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.02 -42.14 3.37 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.358 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -110.16 114.64 28.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.26 -0.9 . . . . 0.0 110.152 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -85.17 -33.75 22.23 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.866 . . . . 0.0 109.93 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.9 t -52.9 -64.79 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.274 -0.891 . . . . 0.0 109.799 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.532 -0.73 . . . . 0.0 109.828 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -53.96 -47.1 71.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.842 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.635 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.34 -46.94 66.3 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.316 -0.865 . . . . 0.0 109.945 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.466 HG23 ' HB3' ' B' ' 38' ' ' PHE . 94.8 t -62.76 -49.12 84.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.326 0 O-C-N 121.206 -0.934 . . . . 0.0 109.871 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.42 ' N ' ' OE1' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -51.28 -56.48 12.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.383 -0.823 . . . . 0.0 110.531 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -53.35 -63.81 1.03 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.452 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 22.8 m-85 -58.29 -53.45 58.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 110.479 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 90.3 m -51.52 -33.66 32.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.138 -0.976 . . . . 0.0 110.164 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.87 -29.83 44.7 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.282 -0.886 . . . . 0.0 109.979 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.62 -34.79 69.67 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.326 -0.859 . . . . 0.0 110.086 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -31.5 69.95 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.262 -0.899 . . . . 0.0 110.162 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -100.03 -30.94 11.69 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.206 -0.934 . . . . 0.0 110.204 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 46' ' ' ARG . . . -60.88 -77.21 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.237 -0.915 . . . . 0.0 110.26 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.9 -90.74 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.792 -0.568 . . . . 0.0 110.955 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 O-C-N 120.86 -1.15 . . . . 0.0 110.207 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.244 0.545 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 19.6 ttt 53.15 76.58 0.2 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.221 -0.924 . . . . 0.0 110.269 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 178.95 105.88 0.2 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -128.04 -70.26 0.7 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.245 -1.15 . . . . 0.0 110.35 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.1 tp -112.51 142.52 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.231 -0.918 . . . . 0.0 110.369 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -167.41 60.74 0.08 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.129 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.63 ' C ' HD12 ' B' ' 7' ' ' ILE . 2.2 pp -126.88 158.04 69.74 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.257 -0.902 . . . . 0.0 110.289 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.35 115.9 4.5 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.789 1.415 . . . . 0.0 110.527 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.01 151.51 50.25 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.471 1.248 . . . . 0.0 110.423 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.96 -32.03 4.92 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -74.59 -27.08 60.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -1.149 . . . . 0.0 110.19 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 92.0 m -57.04 -61.88 2.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.214 -0.929 . . . . 0.0 110.226 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.34 -48.32 55.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.382 -0.824 . . . . 0.0 110.454 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.72 -58.02 9.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.55 -38.44 84.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.307 -0.871 . . . . 0.0 110.314 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.598 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -54.24 -42.81 70.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.059 -1.025 . . . . 0.0 109.76 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.418 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -56.6 -56.16 26.06 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.636 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.4 t80 -47.16 -45.79 23.04 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.519 -0.989 . . . . 0.0 110.4 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -61.33 -32.66 72.54 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.52 -0.737 . . . . 0.0 109.963 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.598 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.2 t -82.78 -27.1 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 110.599 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' B' ' 17' ' ' GLY . 1.0 OUTLIER -80.06 -59.24 2.79 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.133 -0.979 . . . . 0.0 109.083 179.764 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.476 HG23 ' O ' ' B' ' 18' ' ' TYR . 20.5 t -54.97 -32.71 27.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 121.801 -0.562 . . . . 0.0 109.857 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 tp -81.51 -19.79 41.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.154 -0.966 . . . . 0.0 110.134 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -49.48 8.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.252 -0.905 . . . . 0.0 110.447 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.435 ' CG ' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -99.98 -23.69 14.84 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.24 -0.912 . . . . 0.0 110.671 -179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 49.75 70.97 1.73 Allowed Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.079 -1.013 . . . . 0.0 110.519 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.435 ' HD3' ' CG ' ' B' ' 25' ' ' GLN . 44.4 Cg_endo -71.16 153.93 62.21 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.689 1.363 . . . . 0.0 110.364 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.99 -42.02 3.51 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 O-C-N 123.672 1.354 . . . . 0.0 110.299 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -110.36 114.5 28.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.248 -0.908 . . . . 0.0 110.13 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.99 -33.84 22.5 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.229 -0.919 . . . . 0.0 109.969 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.0 t -52.82 -64.76 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.327 -0.858 . . . . 0.0 109.837 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -56.87 -45.86 82.22 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.478 -0.764 . . . . 0.0 109.771 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -54.13 -47.2 72.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.245 -0.909 . . . . 0.0 109.807 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.636 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.26 -46.83 65.97 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.327 -0.858 . . . . 0.0 109.969 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.441 HG23 ' HB3' ' A' ' 38' ' ' PHE . 99.3 t -62.96 -49.0 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 O-C-N 121.278 -0.889 . . . . 0.0 109.873 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.423 ' OE1' ' N ' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -51.32 -56.47 12.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.477 -0.764 . . . . 0.0 110.519 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -53.25 -64.18 0.9 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.287 -0.883 . . . . 0.0 110.424 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.479 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 23.1 m-85 -58.01 -53.28 60.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.205 -0.935 . . . . 0.0 110.534 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.425 ' OG1' HG13 ' A' ' 35' ' ' VAL . 89.5 m -51.69 -33.63 34.89 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.075 -1.016 . . . . 0.0 110.113 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -29.88 44.35 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.273 -0.892 . . . . 0.0 110.024 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.45 -35.06 69.65 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.33 -0.856 . . . . 0.0 110.071 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -59.73 -31.63 69.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.264 -0.897 . . . . 0.0 110.14 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -99.98 -30.82 11.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.252 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.442 ' O ' ' N ' ' B' ' 46' ' ' ARG . . . -60.98 -77.23 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.282 -0.886 . . . . 0.0 110.269 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.81 -90.79 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.874 -0.516 . . . . 0.0 110.979 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' B' ' 44' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 120.842 -1.161 . . . . 0.0 110.265 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 m170 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.211 0.529 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.4 mtm 53.32 178.0 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.301 -0.874 . . . . 0.0 110.26 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.75 112.08 3.46 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.1 t-80 -116.26 48.07 1.31 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -1.171 . . . . 0.0 110.145 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -116.05 75.96 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.262 -0.899 . . . . 0.0 110.368 -179.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -132.44 72.6 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.28 -0.888 . . . . 0.0 109.91 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -102.67 132.41 21.32 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.253 -0.904 . . . . 0.0 110.321 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.62 121.24 6.59 Favored 'Trans proline' 0 C--N 1.313 -1.342 0 O-C-N 123.492 1.259 . . . . 0.0 110.197 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.07 162.08 39.65 Favored 'Trans proline' 0 C--N 1.312 -1.366 0 O-C-N 123.424 1.223 . . . . 0.0 110.599 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.87 -33.92 5.57 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.36 -32.47 49.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -1.126 . . . . 0.0 110.371 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -59.47 -56.09 26.42 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.95 . . . . 0.0 110.261 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -51.93 -30.08 22.95 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.366 -0.834 . . . . 0.0 110.383 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.6 tp -69.85 -56.94 5.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.155 -0.966 . . . . 0.0 110.174 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.84 -46.06 89.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.163 -0.961 . . . . 0.0 110.191 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.76 -33.86 50.44 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.257 -0.902 . . . . 0.0 109.881 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -61.16 -57.63 17.53 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.544 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.1 t80 -45.13 -35.89 3.41 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.676 -0.897 . . . . 0.0 110.711 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.665 ' O ' HD23 ' A' ' 23' ' ' LEU . 31.9 m -67.98 -35.1 77.79 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.825 . . . . 0.0 109.952 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.8 t -85.43 -24.38 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.218 -0.926 . . . . 0.0 110.4 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.428 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -76.9 -56.71 4.36 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.07 -1.019 . . . . 0.0 108.679 179.501 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 18' ' ' TYR . 46.0 t -56.35 -35.98 45.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 121.188 0.518 . . . . 0.0 110.245 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.665 HD23 ' O ' ' A' ' 19' ' ' THR . 3.8 mm? -73.73 -23.11 59.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.255 -0.903 . . . . 0.0 110.377 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.17 -65.39 1.02 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.249 -0.907 . . . . 0.0 110.764 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.79 -29.11 55.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.162 -0.961 . . . . 0.0 110.574 -179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 53.08 76.81 0.49 Allowed Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.185 -0.947 . . . . 0.0 110.055 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.97 156.69 55.93 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.727 1.382 . . . . 0.0 110.558 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.17 -33.5 11.45 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.769 1.405 . . . . 0.0 110.404 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -127.86 116.03 19.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.349 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.419 HD11 ' CE2' ' A' ' 18' ' ' TYR . 11.4 tp -74.35 -44.68 51.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.328 -0.858 . . . . 0.0 110.059 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.436 ' H ' HG23 ' A' ' 31' ' ' VAL . 43.1 t -50.61 -60.85 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.367 -0.833 . . . . 0.0 109.896 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.86 -37.92 77.59 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.629 -0.669 . . . . 0.0 109.945 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.406 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 27.8 t80 -62.57 -51.61 66.69 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.28 -0.888 . . . . 0.0 109.699 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.528 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -36.76 56.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.494 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.7 t -73.94 -51.55 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 O-C-N 121.207 -0.933 . . . . 0.0 110.173 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.24 -29.82 69.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 110.195 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.428 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 74.5 t80 -78.24 -67.39 0.74 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.211 -0.93 . . . . 0.0 110.283 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -51.69 -44.53 63.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.275 -0.89 . . . . 0.0 110.309 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.479 ' OG1' HG13 ' B' ' 35' ' ' VAL . 47.4 m -54.62 -44.56 73.24 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.196 -0.94 . . . . 0.0 109.724 179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -71.49 -27.15 63.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.332 -0.855 . . . . 0.0 109.814 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -62.9 -25.43 68.31 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.331 -0.856 . . . . 0.0 110.027 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.67 -26.71 60.03 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.284 -0.885 . . . . 0.0 109.848 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -103.77 13.78 32.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 110.485 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.67 -69.59 0.76 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.16 -0.962 . . . . 0.0 110.239 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.14 -55.21 10.88 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.571 -0.705 . . . . 0.0 110.454 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.211 179.897 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 8.0 m170 . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.22 0.533 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 5.4 mtm 53.38 178.14 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 110.281 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.88 112.38 3.51 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -116.52 48.02 1.34 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -1.142 . . . . 0.0 110.111 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.629 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -115.96 75.71 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.345 -0.847 . . . . 0.0 110.441 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -132.14 72.56 1.5 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.221 -0.924 . . . . 0.0 110.044 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.3 mm -102.65 132.27 21.48 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.351 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.5 121.2 6.6 Favored 'Trans proline' 0 C--N 1.313 -1.324 0 O-C-N 123.519 1.273 . . . . 0.0 110.289 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -74.1 162.02 39.71 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.441 1.232 . . . . 0.0 110.542 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 97.85 -33.7 5.73 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.45 -32.48 48.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.201 -1.176 . . . . 0.0 110.41 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.2 m -59.4 -56.17 25.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.167 -0.958 . . . . 0.0 110.327 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.9 -29.86 21.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.321 -0.862 . . . . 0.0 110.463 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 17.5 tp -70.11 -56.79 5.99 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -62.98 -45.93 90.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.936 . . . . 0.0 110.187 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -52.79 -34.08 51.83 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.312 -0.867 . . . . 0.0 109.846 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -61.25 -57.53 17.9 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.542 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 2.1 t80 -45.01 -36.12 3.28 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.566 -0.961 . . . . 0.0 110.623 179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.649 ' O ' HD23 ' B' ' 23' ' ' LEU . 33.6 m -67.77 -35.14 78.16 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.437 -0.789 . . . . 0.0 110.04 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.45 -24.39 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.236 -0.915 . . . . 0.0 110.399 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.445 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -76.89 -56.65 4.4 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.184 -0.948 . . . . 0.0 108.698 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 18' ' ' TYR . 46.3 t -56.29 -36.24 45.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 121.206 0.526 . . . . 0.0 110.188 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.649 HD23 ' O ' ' B' ' 19' ' ' THR . 3.8 mm? -73.51 -23.0 59.97 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.32 -65.36 1.02 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.211 -0.931 . . . . 0.0 110.71 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.89 -28.94 55.54 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.175 -0.953 . . . . 0.0 110.659 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 52.98 76.95 0.48 Allowed Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.174 -0.954 . . . . 0.0 110.109 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.11 156.68 55.39 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.765 1.403 . . . . 0.0 110.637 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.12 -33.37 11.74 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 O-C-N 123.779 1.41 . . . . 0.0 110.448 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -128.12 116.12 19.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 110.259 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.42 HD11 ' CE2' ' B' ' 18' ' ' TYR . 11.4 tp -74.47 -44.66 50.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.217 -0.927 . . . . 0.0 110.023 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.422 HG23 ' H ' ' B' ' 31' ' ' VAL . 43.9 t -50.74 -60.88 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.242 -0.911 . . . . 0.0 109.859 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -58.61 -37.9 76.84 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.584 -0.698 . . . . 0.0 109.853 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.41 ' CE2' ' CE1' ' B' ' 18' ' ' TYR . 27.9 t80 -62.87 -51.35 67.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.304 -0.872 . . . . 0.0 109.654 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.542 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -52.84 -36.5 58.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.001 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.479 HG13 ' OG1' ' A' ' 39' ' ' THR . 95.6 t -74.18 -51.55 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.262 -0.898 . . . . 0.0 110.059 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.31 -29.39 68.82 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.253 -0.904 . . . . 0.0 110.377 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.445 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 74.4 t80 -78.53 -67.27 0.76 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.186 -0.946 . . . . 0.0 110.261 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -51.8 -44.54 63.52 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.494 ' OG1' HG13 ' A' ' 35' ' ' VAL . 47.1 m -54.5 -44.53 72.79 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.161 -0.962 . . . . 0.0 109.717 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -71.84 -26.81 62.52 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 109.83 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tp -63.09 -25.26 68.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.475 -0.766 . . . . 0.0 110.037 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -74.84 -26.68 59.87 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.289 -0.882 . . . . 0.0 109.744 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -103.74 13.73 32.46 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.329 -0.857 . . . . 0.0 110.448 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -99.68 -69.54 0.76 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.157 -0.964 . . . . 0.0 110.261 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.34 -55.15 11.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.58 -0.7 . . . . 0.0 110.443 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.068 179.828 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.199 0.523 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -160.23 101.01 1.39 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.265 -0.897 . . . . 0.0 110.144 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.17 -134.41 6.28 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.482 ' C ' HD12 ' A' ' 5' ' ' ILE . 7.6 m-70 -130.74 154.05 48.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.192 -1.181 . . . . 0.0 110.29 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.68 ' N ' HD12 ' A' ' 5' ' ' ILE . 5.2 mp -125.96 149.45 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.274 -0.891 . . . . 0.0 110.099 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -121.55 47.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.239 -0.913 . . . . 0.0 110.198 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 48.2 mm -114.18 124.77 30.28 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.248 -0.907 . . . . 0.0 110.186 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.15 139.53 32.64 Favored 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.424 1.223 . . . . 0.0 110.466 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.25 173.84 13.07 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.588 1.31 . . . . 0.0 110.387 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.16 -35.27 4.34 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.506 HD23 ' C ' ' A' ' 11' ' ' LEU . 9.7 tt -75.04 -32.33 61.53 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.327 -1.102 . . . . 0.0 110.094 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.2 m -62.67 -49.47 75.01 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.228 -0.92 . . . . 0.0 110.126 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.8 tt0 -54.75 -49.96 69.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.292 -0.88 . . . . 0.0 110.257 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.85 -50.0 70.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.353 -0.842 . . . . 0.0 110.327 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.487 HD13 ' HA ' ' A' ' 15' ' ' LEU . 1.5 mm? -56.1 -52.44 64.29 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 110.177 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.464 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -52.28 -33.71 43.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.127 -0.983 . . . . 0.0 109.804 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.425 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.88 -55.45 30.49 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 108.803 -1.719 . . . . 0.0 108.803 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.453 ' CE2' HD11 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -49.78 -45.43 49.72 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.366 -1.079 . . . . 0.0 110.396 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.411 ' O ' ' CB ' ' A' ' 23' ' ' LEU . 85.3 m -59.08 -35.77 73.96 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.401 -0.812 . . . . 0.0 110.069 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 16' ' ' GLN . 85.4 t -76.66 -27.06 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.231 -0.918 . . . . 0.0 110.484 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 0.9 OUTLIER -85.23 -64.22 1.19 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.2 -0.937 . . . . 0.0 109.338 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.408 ' H ' HG23 ' A' ' 22' ' ' VAL . 39.3 t -50.55 -25.76 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 121.752 -0.592 . . . . 0.0 110.451 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 19' ' ' THR . 19.6 tp -88.36 -25.64 22.62 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.244 -0.91 . . . . 0.0 110.205 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.64 -56.38 3.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.159 -0.963 . . . . 0.0 110.529 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 26' ' ' GLN . 5.9 pt20 -85.32 -27.03 26.19 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.075 -1.016 . . . . 0.0 110.581 -179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.463 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.3 OUTLIER 47.87 80.68 0.28 Allowed Pre-proline 0 N--CA 1.495 1.809 0 O-C-N 121.238 -0.914 . . . . 0.0 110.632 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.74 161.66 44.46 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.622 1.327 . . . . 0.0 110.547 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -71.3 -36.02 7.64 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.736 1.387 . . . . 0.0 110.236 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -130.08 113.8 14.97 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.308 -0.87 . . . . 0.0 110.001 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.453 HD11 ' CE2' ' A' ' 18' ' ' TYR . 4.3 tp -67.2 -36.56 81.99 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.349 -0.844 . . . . 0.0 110.367 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.417 ' H ' HG23 ' A' ' 31' ' ' VAL . 44.0 t -51.3 -65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.216 -0.927 . . . . 0.0 110.091 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.24 -40.87 68.14 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.527 -0.733 . . . . 0.0 109.997 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -60.5 -46.71 89.13 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.771 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.666 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -57.78 -44.44 86.23 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.279 -0.888 . . . . 0.0 110.145 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.574 HG13 ' OG1' ' B' ' 39' ' ' THR . 99.0 t -69.91 -34.49 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.301 -0.874 . . . . 0.0 110.021 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.5 40.12 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.279 -0.888 . . . . 0.0 109.751 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 16.1 t80 -76.58 -68.48 0.59 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.158 -0.964 . . . . 0.0 110.291 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.679 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 17.2 m-85 -51.67 -50.31 60.67 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.224 -0.922 . . . . 0.0 110.575 -179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.576 ' OG1' HG13 ' B' ' 35' ' ' VAL . 51.8 m -53.14 -39.07 63.24 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.949 -1.094 . . . . 0.0 110.054 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -73.01 -27.21 61.65 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.33 -0.856 . . . . 0.0 109.989 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.76 -35.47 76.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.358 -0.839 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.1 -38.2 70.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.268 -0.895 . . . . 0.0 110.222 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -71.03 -13.29 61.94 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.223 -0.923 . . . . 0.0 110.576 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.04 -64.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.066 -1.021 . . . . 0.0 110.475 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -47.98 -30.19 4.09 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.454 -0.779 . . . . 0.0 110.844 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.238 179.952 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.256 0.551 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -160.03 101.02 1.42 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.237 -0.914 . . . . 0.0 110.152 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.1 -134.47 6.31 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . 0.48 ' C ' HD12 ' B' ' 5' ' ' ILE . 7.6 m-70 -130.8 153.85 48.64 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -1.128 . . . . 0.0 110.287 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.676 HD12 ' N ' ' B' ' 5' ' ' ILE . 5.3 mp -125.84 149.45 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.294 -0.879 . . . . 0.0 110.166 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -121.6 47.95 1.77 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.319 -0.863 . . . . 0.0 110.211 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.3 mm -114.26 124.64 30.45 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.19 139.51 32.5 Favored 'Trans proline' 0 C--N 1.314 -1.247 0 O-C-N 123.393 1.207 . . . . 0.0 110.359 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.2 173.66 13.34 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.57 1.3 . . . . 0.0 110.334 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.43 -35.34 4.34 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.487 ' C ' HD23 ' B' ' 11' ' ' LEU . 9.8 tt -75.06 -32.32 61.49 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.326 -1.102 . . . . 0.0 110.113 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.8 m -62.58 -49.5 75.0 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.344 -0.848 . . . . 0.0 110.15 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -54.73 -49.97 69.49 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.344 -0.848 . . . . 0.0 110.267 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.84 -50.13 70.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.264 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.448 ' HA ' HD13 ' B' ' 15' ' ' LEU . 1.5 mm? -56.02 -52.61 63.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.46 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.2 OUTLIER -51.97 -33.99 40.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.11 -0.994 . . . . 0.0 109.856 179.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -57.61 -55.6 29.59 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.88 -1.688 . . . . 0.0 108.88 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.469 ' CE2' HD11 ' B' ' 30' ' ' LEU . 1.0 OUTLIER -49.7 -45.53 49.04 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.417 -1.049 . . . . 0.0 110.395 179.535 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.414 ' O ' ' CB ' ' B' ' 23' ' ' LEU . 84.8 m -58.94 -35.63 73.43 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.418 -0.801 . . . . 0.0 110.072 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.46 HG23 ' O ' ' B' ' 16' ' ' GLN . 83.9 t -76.92 -26.92 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.274 -0.891 . . . . 0.0 110.417 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.444 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 0.9 OUTLIER -85.29 -64.21 1.19 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.109 -0.995 . . . . 0.0 109.357 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.423 HG23 ' H ' ' B' ' 22' ' ' VAL . 39.2 t -50.57 -25.68 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.716 -0.615 . . . . 0.0 110.329 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.414 ' CB ' ' O ' ' B' ' 19' ' ' THR . 19.9 tp -88.57 -25.53 22.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.203 -0.936 . . . . 0.0 110.118 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -86.83 -56.32 3.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.167 -0.958 . . . . 0.0 110.494 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.447 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 6.0 pt20 -85.36 -26.94 26.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.153 -0.967 . . . . 0.0 110.596 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.447 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 0.3 OUTLIER 47.86 80.65 0.28 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.177 -0.952 . . . . 0.0 110.524 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.414 ' HD3' ' HG3' ' B' ' 25' ' ' GLN . 45.7 Cg_endo -71.65 161.54 44.94 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.791 1.416 . . . . 0.0 110.567 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -36.09 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.67 1.353 . . . . 0.0 110.212 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -129.86 113.88 15.2 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -0.894 . . . . 0.0 110.001 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.469 HD11 ' CE2' ' B' ' 18' ' ' TYR . 4.3 tp -67.21 -36.51 81.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 110.374 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.41 HG23 ' H ' ' B' ' 31' ' ' VAL . 43.8 t -51.34 -65.4 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.255 -0.903 . . . . 0.0 110.09 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.52 -40.57 68.73 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.437 -0.79 . . . . 0.0 109.923 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -60.55 -47.0 88.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.22 -0.925 . . . . 0.0 109.755 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.679 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -57.36 -44.46 84.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.264 -0.898 . . . . 0.0 110.252 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.576 HG13 ' OG1' ' A' ' 39' ' ' THR . 98.1 t -70.06 -34.48 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.204 -0.935 . . . . 0.0 109.987 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.85 -27.58 40.14 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.359 -0.838 . . . . 0.0 109.748 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.444 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 16.2 t80 -76.42 -68.44 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.981 . . . . 0.0 110.383 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.666 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 17.4 m-85 -51.84 -50.2 61.36 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.574 ' OG1' HG13 ' A' ' 35' ' ' VAL . 51.8 m -53.21 -38.99 63.38 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.082 -1.011 . . . . 0.0 110.047 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -73.08 -27.24 61.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.946 179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -35.5 76.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.339 -0.851 . . . . 0.0 110.11 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -56.07 -38.34 70.53 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 110.174 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.88 -13.32 61.99 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.64 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -94.11 -64.25 1.1 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.436 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -48.15 -29.86 4.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.499 -0.751 . . . . 0.0 110.753 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 27.5 mtp180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.22 179.893 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.214 0.53 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mtm -110.39 105.27 14.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.2 -0.937 . . . . 0.0 110.283 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.69 100.63 2.34 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -143.97 152.01 40.5 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.294 -1.121 . . . . 0.0 110.251 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.405 HG13 ' N ' ' A' ' 6' ' ' GLN . 1.4 tp -120.39 150.11 23.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.2 -0.937 . . . . 0.0 110.303 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.405 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -172.57 91.46 0.11 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.236 -0.915 . . . . 0.0 110.264 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.619 ' N ' HD12 ' A' ' 7' ' ' ILE . 1.8 mp -89.53 110.29 37.98 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.0 109.52 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.46 157.35 56.6 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.533 1.281 . . . . 0.0 110.819 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -75.23 164.41 32.99 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.733 1.386 . . . . 0.0 110.522 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.06 -23.79 32.46 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.759 HD11 HG11 ' B' ' 22' ' ' VAL . 0.2 OUTLIER -86.34 -19.74 29.34 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.268 -1.136 . . . . 0.0 110.312 -179.937 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 70.3 m -77.04 -45.64 26.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.237 -0.914 . . . . 0.0 110.286 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -55.05 -57.35 12.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.304 -0.872 . . . . 0.0 110.121 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.03 -54.03 41.33 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 110.238 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.36 -40.52 74.65 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.314 -0.867 . . . . 0.0 110.244 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.26 -40.03 73.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.145 -0.972 . . . . 0.0 109.787 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.55 -53.65 39.91 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.624 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.4 t80 -48.49 -48.72 37.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.426 -1.044 . . . . 0.0 110.209 179.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 51.8 m -54.5 -32.5 58.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.474 -0.766 . . . . 0.0 110.221 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.19 -24.62 10.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.229 -0.919 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.48 ' OE2' ' CE1' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -88.65 -58.55 2.51 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.743 HG11 HD11 ' B' ' 11' ' ' LEU . 50.4 t -50.59 -41.12 20.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.735 -0.603 . . . . 0.0 110.364 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.2 -34.76 59.29 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.133 -0.98 . . . . 0.0 110.186 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.34 -49.45 14.93 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 110.324 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.09 -37.06 58.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.211 -0.93 . . . . 0.0 110.351 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.431 ' N ' ' CD ' ' A' ' 27' ' ' PRO . 2.1 mt-30 53.21 53.95 12.18 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.237 -0.914 . . . . 0.0 110.285 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 26' ' ' GLN . 43.5 Cg_endo -70.2 157.13 60.48 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.672 1.354 . . . . 0.0 110.48 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.0 -32.91 10.44 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.653 1.344 . . . . 0.0 110.411 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -120.14 122.75 41.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.229 -0.919 . . . . 0.0 110.281 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 tp -85.69 -36.83 20.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.21 -0.931 . . . . 0.0 110.114 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.459 HG12 ' HD3' ' B' ' 42' ' ' ARG . 45.8 t -51.47 -57.78 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.21 -0.931 . . . . 0.0 109.903 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -62.36 -37.38 85.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.643 -0.661 . . . . 0.0 110.087 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -65.39 -43.17 91.54 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.274 -0.891 . . . . 0.0 109.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.624 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -57.59 -37.93 74.02 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.404 -0.81 . . . . 0.0 110.062 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.526 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.2 t -69.71 -50.34 50.62 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.287 0 O-C-N 121.21 -0.931 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.76 -26.09 65.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.861 . . . . 0.0 110.505 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.48 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 12.4 t80 -75.82 -68.69 0.55 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.125 -0.984 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 41' ' ' LEU . 45.3 m-85 -57.81 -47.97 81.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.263 -0.898 . . . . 0.0 110.625 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.482 ' OG1' HG13 ' B' ' 35' ' ' VAL . 64.6 m -51.27 -45.52 62.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.12 -0.987 . . . . 0.0 110.023 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -74.0 -26.49 60.47 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.299 -0.875 . . . . 0.0 109.628 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.442 ' HB2' ' HA ' ' A' ' 38' ' ' PHE . 1.3 tp -53.31 -36.55 61.37 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 109.932 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -42.15 92.25 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.319 -0.863 . . . . 0.0 110.113 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -85.31 -16.33 40.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.293 -0.879 . . . . 0.0 110.452 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.87 -67.91 0.25 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.08 -1.012 . . . . 0.0 110.091 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.95 -45.71 31.49 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.557 -0.714 . . . . 0.0 110.835 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.9 ttm-85 . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.379 -179.808 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.294 0.569 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.0 mtm -110.65 105.44 14.34 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -0.922 . . . . 0.0 110.119 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.98 100.53 2.3 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -143.89 152.11 40.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -1.184 . . . . 0.0 110.254 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.41 HG13 ' N ' ' B' ' 6' ' ' GLN . 1.4 tp -120.34 150.05 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.295 -0.878 . . . . 0.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . 0.41 ' N ' HG13 ' B' ' 5' ' ' ILE . 0.0 OUTLIER -172.6 91.25 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.276 -0.89 . . . . 0.0 110.391 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.63 HD12 ' N ' ' B' ' 7' ' ' ILE . 1.8 mp -89.35 110.15 36.65 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.277 -0.89 . . . . 0.0 109.57 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.48 157.33 56.56 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.565 1.297 . . . . 0.0 110.782 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -75.18 164.24 33.4 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.8 1.421 . . . . 0.0 110.508 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.2 -23.85 32.12 Favored Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.743 HD11 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -86.36 -19.62 29.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -1.136 . . . . 0.0 110.308 -179.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 66.5 m -77.14 -45.66 26.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.239 -0.913 . . . . 0.0 110.269 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -54.98 -57.41 11.79 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 110.147 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 11.1 mt -53.07 -53.98 42.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.333 -0.855 . . . . 0.0 110.245 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.35 -40.67 74.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -39.76 72.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.116 -0.99 . . . . 0.0 109.922 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.91 -53.47 41.91 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 108.807 -1.717 . . . . 0.0 108.807 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.631 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.5 t80 -48.7 -48.46 40.23 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.429 -1.042 . . . . 0.0 110.263 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.2 m -54.58 -32.43 58.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.469 -0.769 . . . . 0.0 110.185 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 96.2 t -81.25 -24.85 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.348 -0.845 . . . . 0.0 110.54 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.471 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.8 OUTLIER -88.44 -58.47 2.54 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.181 -0.949 . . . . 0.0 109.296 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.759 HG11 HD11 ' A' ' 11' ' ' LEU . 49.8 t -50.67 -40.96 20.11 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.765 -0.584 . . . . 0.0 110.414 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.3 -34.9 59.05 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.175 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.29 -49.35 15.2 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.141 -0.975 . . . . 0.0 110.339 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -76.23 -36.96 58.3 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.199 -0.938 . . . . 0.0 110.374 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.425 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 2.1 mt-30 53.15 53.97 12.29 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.235 -0.916 . . . . 0.0 110.352 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.7 Cg_endo -70.22 157.04 60.75 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.735 1.387 . . . . 0.0 110.503 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.76 -33.1 10.71 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 O-C-N 123.729 1.384 . . . . 0.0 110.498 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -120.08 123.03 42.39 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.18 -0.95 . . . . 0.0 110.365 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -85.81 -37.12 19.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.074 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.426 HG23 ' H ' ' B' ' 31' ' ' VAL . 46.0 t -51.04 -57.93 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.261 -0.9 . . . . 0.0 110.004 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -62.31 -37.43 85.53 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.527 -0.733 . . . . 0.0 110.17 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -65.17 -43.45 91.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.941 . . . . 0.0 109.854 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.631 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.38 -38.15 73.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.306 -0.871 . . . . 0.0 110.154 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.482 HG13 ' OG1' ' A' ' 39' ' ' THR . 99.9 t -69.54 -50.18 52.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 O-C-N 121.271 -0.893 . . . . 0.0 110.183 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.92 -26.12 65.68 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.298 -0.876 . . . . 0.0 110.512 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.471 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 12.2 t80 -75.91 -68.66 0.55 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.431 ' HA ' ' HB2' ' B' ' 41' ' ' LEU . 45.7 m-85 -57.81 -47.71 81.83 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.245 -0.909 . . . . 0.0 110.534 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.526 ' OG1' HG13 ' A' ' 35' ' ' VAL . 68.9 m -51.47 -45.64 62.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.022 -1.049 . . . . 0.0 109.963 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -73.74 -26.78 60.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 109.688 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.431 ' HB2' ' HA ' ' B' ' 38' ' ' PHE . 1.3 tp -53.29 -36.55 61.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 109.91 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.459 ' HD3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -59.68 -42.48 93.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.341 -0.849 . . . . 0.0 110.036 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -84.89 -16.42 41.23 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.401 -0.812 . . . . 0.0 110.529 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.88 -67.59 0.28 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.146 -0.971 . . . . 0.0 110.295 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.95 -45.95 31.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.532 -0.73 . . . . 0.0 110.695 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 37.3 ttm-85 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.409 -179.874 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.0 m170 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.24 0.543 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 14.9 mmt -116.01 136.93 52.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.34 -0.85 . . . . 0.0 110.164 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -124.49 -170.58 13.23 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -129.73 32.85 4.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.181 -1.188 . . . . 0.0 110.135 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 48.0 mm -106.36 126.91 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.301 -0.874 . . . . 0.0 110.265 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -118.08 108.68 15.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.254 -0.904 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.45 115.06 52.33 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.142 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.21 137.43 28.66 Favored 'Trans proline' 0 C--N 1.313 -1.29 0 O-C-N 123.451 1.237 . . . . 0.0 110.406 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -75.25 151.11 38.04 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.573 1.302 . . . . 0.0 110.517 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.86 -27.71 8.52 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -26.08 30.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.224 -1.163 . . . . 0.0 110.303 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -53.47 -56.4 17.27 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.219 -0.926 . . . . 0.0 110.323 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.46 -50.14 63.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.401 -0.812 . . . . 0.0 110.408 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 mp -52.83 -53.49 47.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.342 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 15' ' ' LEU . 4.6 mm? -65.37 -51.89 57.39 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 110.434 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.5 -33.05 43.22 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.062 -1.024 . . . . 0.0 109.897 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.412 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -59.23 -55.85 28.48 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 108.913 -1.675 . . . . 0.0 108.913 179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.458 ' CE2' HD11 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -48.2 -44.78 33.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.407 -1.055 . . . . 0.0 110.391 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -55.63 -37.32 68.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.416 -0.802 . . . . 0.0 110.204 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.6 t -80.56 -25.64 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.671 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -85.67 -58.48 2.64 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.001 -1.062 . . . . 0.0 109.083 179.958 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.43 ' H ' HG23 ' A' ' 22' ' ' VAL . 38.9 t -52.03 -34.09 17.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.5 0 O-C-N 121.757 -0.589 . . . . 0.0 110.179 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.5 -33.9 54.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.07 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.54 -66.28 0.91 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.263 -0.898 . . . . 0.0 110.12 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.71 -40.89 66.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.249 -0.907 . . . . 0.0 110.068 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.49 56.61 13.75 Favored Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.307 -0.871 . . . . 0.0 110.364 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.51 151.32 58.85 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.66 1.347 . . . . 0.0 110.295 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.78 -28.39 20.43 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.701 1.369 . . . . 0.0 110.26 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.65 120.05 30.76 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.315 -0.866 . . . . 0.0 110.086 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.458 HD11 ' CE2' ' A' ' 18' ' ' TYR . 9.4 tp -82.88 -36.63 25.2 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.252 -0.905 . . . . 0.0 110.287 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 31' ' ' VAL . 44.8 t -51.02 -63.58 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.186 -0.946 . . . . 0.0 110.112 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.48 -35.76 72.69 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.455 -0.778 . . . . 0.0 110.103 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -66.58 -43.18 85.61 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 109.909 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.595 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -59.77 -35.29 74.33 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.389 -0.819 . . . . 0.0 110.275 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.483 HG13 ' OG1' ' B' ' 39' ' ' THR . 89.4 t -74.24 -45.56 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 121.224 -0.923 . . . . 0.0 110.341 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.47 -20.64 66.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.25 -0.906 . . . . 0.0 110.373 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.51 -71.28 0.4 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.19 -0.944 . . . . 0.0 110.353 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.563 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 42.8 m-85 -56.48 -47.21 79.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.203 -0.936 . . . . 0.0 110.447 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.471 ' OG1' HG13 ' B' ' 35' ' ' VAL . 86.3 m -51.82 -42.85 62.82 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -75.15 -23.45 57.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.194 -0.941 . . . . 0.0 110.03 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.07 -32.73 74.39 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.291 -0.88 . . . . 0.0 110.033 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -29.4 34.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.304 -0.872 . . . . 0.0 110.017 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.4 -23.24 40.52 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.418 -0.802 . . . . 0.0 110.1 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.28 -75.73 0.14 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.252 -0.905 . . . . 0.0 110.383 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 48.81 -153.65 0.1 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.607 -0.683 . . . . 0.0 110.624 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.237 -179.951 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 38.0 m170 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.16 0.505 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 15.0 mmt -115.98 136.86 52.64 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.0 110.211 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -124.29 -170.49 13.26 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -129.89 32.81 4.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.298 -1.119 . . . . 0.0 110.144 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 47.9 mm -106.41 126.77 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.341 -0.85 . . . . 0.0 110.295 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -117.87 108.84 15.81 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 110.273 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.57 114.95 52.14 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.073 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.09 137.42 28.94 Favored 'Trans proline' 0 C--N 1.314 -1.264 0 O-C-N 123.436 1.229 . . . . 0.0 110.44 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -75.24 150.99 37.93 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.616 1.324 . . . . 0.0 110.454 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.01 -27.81 8.4 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.28 -26.01 31.06 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.281 -1.129 . . . . 0.0 110.263 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 38.9 m -53.64 -56.25 18.85 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.278 -0.889 . . . . 0.0 110.309 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -52.58 -50.19 63.48 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.361 -0.837 . . . . 0.0 110.365 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.75 -53.57 46.14 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 110.388 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.449 HD22 ' N ' ' B' ' 15' ' ' LEU . 4.6 mm? -65.27 -51.9 57.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.216 -0.928 . . . . 0.0 110.404 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -52.58 -33.09 44.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.085 -1.01 . . . . 0.0 109.905 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -59.15 -55.87 28.38 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 108.929 -1.669 . . . . 0.0 108.929 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.46 ' CE2' HD11 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -48.23 -44.57 33.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.37 -1.077 . . . . 0.0 110.416 179.511 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.2 m -55.74 -37.41 68.44 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 110.264 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 86.3 t -80.4 -25.8 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.707 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 0.6 OUTLIER -85.58 -58.34 2.7 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.999 -1.063 . . . . 0.0 109.158 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 18' ' ' TYR . 38.5 t -52.25 -33.98 17.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 O-C-N 121.775 -0.578 . . . . 0.0 110.27 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.1 tp -77.61 -33.77 53.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.166 -0.959 . . . . 0.0 109.976 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.59 -66.17 0.92 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.282 -0.886 . . . . 0.0 110.105 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.79 -41.02 66.8 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.232 -0.917 . . . . 0.0 109.973 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 53.61 56.51 13.5 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.432 -0.793 . . . . 0.0 110.317 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.32 151.31 60.0 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.603 1.317 . . . . 0.0 110.307 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.65 -28.49 20.9 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.744 1.392 . . . . 0.0 110.327 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -124.6 120.3 31.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.369 -0.832 . . . . 0.0 110.052 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.46 HD11 ' CE2' ' B' ' 18' ' ' TYR . 9.1 tp -83.18 -36.36 24.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.247 -0.908 . . . . 0.0 110.216 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.424 HG23 ' H ' ' B' ' 31' ' ' VAL . 44.6 t -51.17 -63.44 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.246 -0.909 . . . . 0.0 110.052 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -58.62 -35.76 72.99 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.412 -0.805 . . . . 0.0 110.17 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -66.55 -43.28 85.5 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.196 -0.94 . . . . 0.0 109.829 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.563 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -59.66 -35.45 74.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 110.258 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.471 HG13 ' OG1' ' A' ' 39' ' ' THR . 91.0 t -74.24 -45.37 47.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.184 -0.948 . . . . 0.0 110.359 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.6 -20.56 66.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.252 -0.905 . . . . 0.0 110.315 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -76.57 -71.4 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.147 -0.971 . . . . 0.0 110.36 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.595 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 43.1 m-85 -56.32 -47.2 79.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.214 -0.928 . . . . 0.0 110.435 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.483 ' OG1' HG13 ' A' ' 35' ' ' VAL . 86.8 m -51.78 -42.88 62.75 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.173 -0.954 . . . . 0.0 110.307 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -75.06 -23.64 58.09 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.266 -0.896 . . . . 0.0 110.064 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -32.88 74.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.225 -0.922 . . . . 0.0 110.069 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -29.44 32.91 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.205 -0.934 . . . . 0.0 109.996 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.4 -23.3 40.49 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.23 -75.8 0.14 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.849 . . . . 0.0 110.393 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 48.89 -153.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.619 -0.675 . . . . 0.0 110.615 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.208 179.999 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.242 0.544 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 ttp -140.94 26.73 2.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.2 -0.938 . . . . 0.0 110.132 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 98.01 94.77 1.96 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -163.41 130.7 3.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -1.161 . . . . 0.0 110.257 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.541 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.0 OUTLIER -111.01 64.74 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.258 -0.901 . . . . 0.0 110.177 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -104.99 175.4 5.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.6 mm -99.79 104.84 30.8 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.27 147.21 59.12 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.608 1.32 . . . . 0.0 110.591 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.22 171.08 16.72 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.717 1.377 . . . . 0.0 110.493 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.819 ' O ' HD12 ' A' ' 14' ' ' LEU . . . 98.22 -32.54 6.81 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.469 HD12 ' HG ' ' B' ' 30' ' ' LEU . 3.9 tp -87.82 -41.01 13.55 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.263 -1.14 . . . . 0.0 110.116 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.2 m -57.86 -57.61 12.0 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.976 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.08 21.59 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.404 -0.81 . . . . 0.0 109.984 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.819 HD12 ' O ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER -77.49 -49.58 14.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 109.997 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.39 -53.1 32.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.268 -0.895 . . . . 0.0 109.991 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.491 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -52.15 -43.16 63.92 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.818 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -55.15 -52.11 49.37 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.817 -1.713 . . . . 0.0 108.817 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.623 ' HE2' HD11 ' A' ' 30' ' ' LEU . 1.7 t80 -49.14 -49.34 42.66 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.405 -1.056 . . . . 0.0 110.17 179.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.0 m -55.7 -36.62 67.38 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.422 -0.799 . . . . 0.0 110.012 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 16' ' ' GLN . 47.6 t -75.04 -25.1 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.249 -0.907 . . . . 0.0 110.601 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.468 ' OE2' ' CZ ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -86.87 -57.99 2.77 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.178 -0.951 . . . . 0.0 109.254 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 18' ' ' TYR . 41.2 t -48.17 -30.99 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.753 -0.592 . . . . 0.0 110.484 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.55 HD21 HD11 ' B' ' 5' ' ' ILE . 2.8 tp -81.89 -37.71 26.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.189 -0.944 . . . . 0.0 110.128 179.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -77.62 -27.73 51.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.481 -179.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 3.5 pm0 -135.48 51.26 2.08 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.11 -0.994 . . . . 0.0 110.615 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -37.75 97.98 0.15 Allowed Pre-proline 0 N--CA 1.501 2.079 0 O-C-N 121.964 -0.46 . . . . 0.0 111.458 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.6 Cg_endo -74.11 166.31 29.88 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 O-C-N 123.984 1.518 . . . . 0.0 110.552 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.59 -41.7 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.704 1.371 . . . . 0.0 110.273 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -122.04 116.38 24.18 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.896 . . . . 0.0 110.218 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.623 HD11 ' HE2' ' A' ' 18' ' ' TYR . 0.8 OUTLIER -69.83 -45.1 68.58 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.225 -0.922 . . . . 0.0 109.686 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -51.79 -59.88 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.256 -0.902 . . . . 0.0 109.881 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.46 -38.74 78.16 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.582 -0.699 . . . . 0.0 109.994 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -60.31 -46.97 88.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.206 -0.933 . . . . 0.0 109.685 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.722 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -50.96 -38.44 50.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.425 -0.797 . . . . 0.0 110.389 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.486 HG13 ' OG1' ' B' ' 39' ' ' THR . 46.4 t -71.48 -55.28 14.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.214 -0.929 . . . . 0.0 110.302 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.37 -38.34 68.72 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.262 -0.899 . . . . 0.0 110.589 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.468 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 14.6 t80 -68.07 -64.87 0.78 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.215 -0.928 . . . . 0.0 110.55 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.728 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 23.1 m-85 -60.23 -45.58 92.74 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.256 -0.902 . . . . 0.0 110.665 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.494 ' OG1' HG13 ' B' ' 35' ' ' VAL . 96.6 m -56.44 -42.45 78.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.13 -0.981 . . . . 0.0 110.399 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.4 ttt180 -73.9 -27.11 60.88 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.12 -0.987 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.19 -36.71 78.25 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.254 -0.903 . . . . 0.0 110.269 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.58 -40.28 74.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 110.313 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -80.54 -30.93 37.12 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.175 -0.953 . . . . 0.0 110.221 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.34 -71.41 0.07 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.257 -0.902 . . . . 0.0 110.358 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -50.33 -40.89 50.32 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.439 -0.788 . . . . 0.0 110.461 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.4 ttt180 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.287 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.289 0.566 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.5 ttp -141.05 26.9 2.0 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.249 -0.907 . . . . 0.0 110.178 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 97.84 94.7 1.95 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -163.3 130.71 3.52 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.287 -1.125 . . . . 0.0 110.255 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.55 HD11 HD21 ' A' ' 23' ' ' LEU . 1.0 OUTLIER -110.87 64.71 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.172 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -105.14 175.26 5.55 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 46.7 mm -99.69 104.95 31.12 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 109.976 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.33 147.29 58.89 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 O-C-N 123.556 1.293 . . . . 0.0 110.51 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.25 171.04 16.83 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.72 1.379 . . . . 0.0 110.539 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . 0.84 ' O ' HD12 ' B' ' 14' ' ' LEU . . . 98.23 -32.52 6.83 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.265 -1.534 . . . . 0.0 109.265 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.532 HD12 ' HG ' ' A' ' 30' ' ' LEU . 3.9 tp -87.84 -40.95 13.58 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.329 -1.101 . . . . 0.0 110.083 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 97.3 m -57.95 -57.54 12.34 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.168 -0.957 . . . . 0.0 109.941 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -53.73 -26.15 21.92 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.365 -0.835 . . . . 0.0 109.911 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.84 HD12 ' O ' ' B' ' 10' ' ' GLY . 1.0 OUTLIER -77.34 -49.86 14.05 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.338 -0.851 . . . . 0.0 109.951 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp -67.31 -52.96 34.12 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.495 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -52.27 -43.06 64.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.113 -0.992 . . . . 0.0 109.766 179.614 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.419 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -55.33 -51.84 51.64 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 108.826 -1.71 . . . . 0.0 108.826 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.621 ' HE2' HD11 ' B' ' 30' ' ' LEU . 1.7 t80 -49.33 -49.28 44.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.41 -1.053 . . . . 0.0 110.119 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 45.3 m -55.69 -36.71 67.44 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.452 -0.78 . . . . 0.0 110.049 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 16' ' ' GLN . 47.6 t -75.04 -25.04 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 110.518 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.46 ' OE2' ' CZ ' ' B' ' 37' ' ' TYR . 1.0 OUTLIER -86.78 -58.2 2.69 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.039 -1.038 . . . . 0.0 109.338 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 18' ' ' TYR . 41.1 t -48.04 -30.89 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.77 -0.582 . . . . 0.0 110.559 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.509 HD21 HD11 ' A' ' 5' ' ' ILE . 2.9 tp -82.06 -37.6 26.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.149 -0.97 . . . . 0.0 110.099 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -27.84 50.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.258 -0.901 . . . . 0.0 110.415 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' B' ' 27' ' ' PRO . 3.4 pm0 -135.44 51.45 2.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.135 -0.978 . . . . 0.0 110.52 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' B' ' 22' ' ' VAL . 3.2 mt-30 -37.94 98.05 0.15 Allowed Pre-proline 0 N--CA 1.5 2.035 0 O-C-N 122.009 -0.432 . . . . 0.0 111.464 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 47.8 Cg_endo -74.13 166.25 30.02 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.939 1.494 . . . . 0.0 110.58 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.48 -41.84 2.17 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.663 1.349 . . . . 0.0 110.263 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -121.93 116.49 24.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 110.268 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.621 HD11 ' HE2' ' B' ' 18' ' ' TYR . 0.8 OUTLIER -69.99 -45.06 68.12 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.215 -0.928 . . . . 0.0 109.655 179.789 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.0 t -51.72 -59.95 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 109.776 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -58.41 -38.95 78.43 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.668 -0.645 . . . . 0.0 109.914 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -60.21 -46.86 88.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.216 -0.927 . . . . 0.0 109.699 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.728 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -50.95 -38.55 51.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.369 -0.832 . . . . 0.0 110.333 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.494 HG13 ' OG1' ' A' ' 39' ' ' THR . 46.4 t -71.39 -55.41 13.89 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.193 -0.942 . . . . 0.0 110.299 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -55.2 -38.4 68.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.187 -0.946 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.46 ' CZ ' ' OE2' ' B' ' 21' ' ' GLU . 14.6 t80 -68.14 -64.86 0.78 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.888 . . . . 0.0 110.501 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.722 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 23.4 m-85 -60.31 -45.38 93.6 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.733 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.486 ' OG1' HG13 ' A' ' 35' ' ' VAL . 96.9 m -56.66 -42.23 78.6 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.992 -1.068 . . . . 0.0 110.348 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -74.22 -26.88 60.51 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.29 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -60.26 -36.58 78.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.223 -0.923 . . . . 0.0 110.303 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -56.68 -40.28 75.29 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.236 -0.915 . . . . 0.0 110.409 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -80.51 -30.97 37.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.163 -0.961 . . . . 0.0 110.232 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.26 -71.42 0.07 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.334 -0.854 . . . . 0.0 110.347 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -50.19 -41.06 48.87 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.504 -0.748 . . . . 0.0 110.475 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 11.4 ttt180 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.214 -179.968 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.226 0.536 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.95 64.36 1.54 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.3 -0.875 . . . . 0.0 110.16 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.69 67.09 0.01 OUTLIER Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 10.2 m80 -143.75 -68.24 0.33 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.167 -1.196 . . . . 0.0 110.273 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.727 HG23 HD11 ' A' ' 7' ' ' ILE . 5.6 tp -113.42 154.55 14.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.846 . . . . 0.0 110.201 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.724 ' C ' HD12 ' A' ' 7' ' ' ILE . 10.3 mm100 -112.36 135.14 53.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.283 -0.886 . . . . 0.0 110.175 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.727 HD11 HG23 ' A' ' 5' ' ' ILE . 4.5 mp -129.45 57.32 29.63 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.198 -0.939 . . . . 0.0 109.95 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -71.77 151.04 57.07 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.766 1.403 . . . . 0.0 110.607 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.99 178.27 6.7 Favored 'Trans proline' 0 C--N 1.311 -1.395 0 O-C-N 123.749 1.394 . . . . 0.0 110.364 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.35 -25.96 12.88 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.49 -51.16 5.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.174 -1.192 . . . . 0.0 110.27 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 69.7 m -52.79 -25.57 11.73 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.239 -0.913 . . . . 0.0 110.157 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.44 -58.96 3.32 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.165 -0.96 . . . . 0.0 110.239 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.68 -41.47 73.76 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.177 -0.952 . . . . 0.0 110.098 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.29 -44.81 95.05 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.328 -0.857 . . . . 0.0 110.087 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.05 -38.56 65.37 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.171 -0.956 . . . . 0.0 109.698 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.433 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.53 -58.39 14.81 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.76 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.7 t80 -46.0 -40.24 10.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.511 -0.993 . . . . 0.0 110.685 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 78.2 m -62.7 -36.01 81.57 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.388 -0.82 . . . . 0.0 110.01 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 96.8 t -82.18 -21.84 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.26 -0.9 . . . . 0.0 110.745 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.454 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.24 8.79 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.028 -1.045 . . . . 0.0 109.332 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 18' ' ' TYR . 76.9 t -60.71 -34.5 59.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 121.7 -0.625 . . . . 0.0 110.408 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.36 -41.32 22.18 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.124 -0.985 . . . . 0.0 110.277 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -69.57 0.44 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.159 -0.963 . . . . 0.0 110.307 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.38 -36.87 64.35 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.253 -0.904 . . . . 0.0 110.173 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.11 59.6 14.47 Favored Pre-proline 0 N--CA 1.492 1.672 0 O-C-N 121.23 -0.919 . . . . 0.0 110.157 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.98 149.8 59.73 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.715 1.376 . . . . 0.0 110.508 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.99 -29.98 17.25 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.723 1.38 . . . . 0.0 110.294 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -125.06 119.64 29.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -78.6 -35.68 45.39 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.289 -0.882 . . . . 0.0 110.246 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.7 t -51.05 -68.5 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.228 -0.92 . . . . 0.0 110.108 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.99 -41.54 71.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.469 -0.77 . . . . 0.0 109.785 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -58.58 -51.81 68.31 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.273 -0.892 . . . . 0.0 109.534 179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.76 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -53.66 -44.62 69.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.439 -0.788 . . . . 0.0 110.022 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.629 HG13 ' OG1' ' B' ' 39' ' ' THR . 92.9 t -71.04 -29.74 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 O-C-N 121.315 -0.866 . . . . 0.0 110.07 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.23 -26.6 39.02 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.259 -0.901 . . . . 0.0 109.586 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.454 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 27.8 t80 -76.57 -68.12 0.63 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.206 -0.933 . . . . 0.0 110.427 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -52.94 -45.81 67.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.304 -0.872 . . . . 0.0 110.65 -179.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.618 ' OG1' HG13 ' B' ' 35' ' ' VAL . 24.0 m -54.51 -40.89 69.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.983 -1.073 . . . . 0.0 109.889 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -28.75 68.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 mt -75.57 -24.65 56.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 110.337 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -47.91 50.11 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.225 -0.922 . . . . 0.0 109.695 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.41 -26.91 68.74 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.356 -0.84 . . . . 0.0 110.047 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.96 -63.04 1.14 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.335 -0.853 . . . . 0.0 110.202 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.06 -64.08 0.89 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.538 -0.726 . . . . 0.0 110.696 -179.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.243 0.544 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.04 64.31 1.54 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.274 -0.891 . . . . 0.0 110.227 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.79 66.93 0.01 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -143.66 -68.17 0.34 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -1.171 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.72 HG23 HD11 ' B' ' 7' ' ' ILE . 5.5 tp -113.51 154.53 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.296 -0.878 . . . . 0.0 110.157 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . 0.722 ' C ' HD12 ' B' ' 7' ' ' ILE . 10.3 mm100 -112.22 134.96 53.46 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.217 -0.927 . . . . 0.0 110.258 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.722 HD12 ' C ' ' B' ' 6' ' ' GLN . 4.5 mp -129.27 57.39 29.92 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.331 -0.855 . . . . 0.0 110.086 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -71.83 151.04 56.67 Favored 'Trans proline' 0 C--N 1.31 -1.489 0 O-C-N 123.682 1.359 . . . . 0.0 110.683 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.96 178.25 6.7 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.706 1.372 . . . . 0.0 110.415 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.27 -25.85 13.16 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.58 -51.06 5.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.134 -1.215 . . . . 0.0 110.293 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 69.3 m -52.98 -25.57 12.48 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.224 -0.922 . . . . 0.0 110.205 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -69.33 -59.09 3.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.279 -0.888 . . . . 0.0 110.16 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.51 -41.56 73.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mp -60.14 -44.91 94.58 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.191 -0.943 . . . . 0.0 110.128 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -38.58 65.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -0.983 . . . . 0.0 109.732 179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.427 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -57.74 -58.23 15.66 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.93 -1.668 . . . . 0.0 108.93 179.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.771 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.7 t80 -45.92 -40.33 10.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.534 -0.98 . . . . 0.0 110.67 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 80.1 m -62.72 -35.97 81.47 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.406 -0.809 . . . . 0.0 110.104 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 98.8 t -82.27 -21.72 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.749 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.464 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.5 mt-10 -87.75 -47.39 8.67 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.082 -1.011 . . . . 0.0 109.213 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 18' ' ' TYR . 73.6 t -60.6 -34.55 58.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.762 -0.586 . . . . 0.0 110.452 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mp -81.26 -41.34 22.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.122 -0.986 . . . . 0.0 110.251 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -69.62 0.44 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.881 . . . . 0.0 110.302 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -54.24 -36.75 63.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.304 -0.873 . . . . 0.0 110.269 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 51.94 59.77 14.47 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.267 -0.896 . . . . 0.0 110.174 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.02 149.76 59.43 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.682 1.359 . . . . 0.0 110.529 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -71.04 -29.98 17.06 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.655 1.345 . . . . 0.0 110.327 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -125.03 119.6 29.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.134 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -78.43 -35.9 46.27 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.311 -0.868 . . . . 0.0 110.191 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 57.5 t -50.88 -68.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.277 -0.89 . . . . 0.0 110.203 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.94 -41.61 71.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.394 -0.816 . . . . 0.0 109.711 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -58.54 -51.99 67.56 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.294 -0.879 . . . . 0.0 109.511 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.771 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -53.66 -44.5 69.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.363 -0.836 . . . . 0.0 110.027 179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.618 HG13 ' OG1' ' A' ' 39' ' ' THR . 90.9 t -71.13 -29.73 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.269 -0.895 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.06 -26.6 39.59 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.241 -0.912 . . . . 0.0 109.546 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.464 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 27.8 t80 -76.67 -68.03 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.17 -0.956 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -53.03 -45.7 68.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.244 -0.91 . . . . 0.0 110.592 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.629 ' OG1' HG13 ' A' ' 35' ' ' VAL . 23.8 m -54.55 -41.11 69.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.022 -1.049 . . . . 0.0 109.753 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -28.83 68.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.188 -0.945 . . . . 0.0 109.974 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.1 mt -75.64 -24.65 56.45 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 110.341 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -47.78 51.26 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.169 -0.957 . . . . 0.0 109.684 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.52 -26.88 68.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 109.972 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.78 -63.21 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.317 -0.865 . . . . 0.0 110.138 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.12 -64.08 0.89 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.559 -0.713 . . . . 0.0 110.731 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.18 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.263 0.554 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -111.66 -47.81 3.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.866 . . . . 0.0 110.122 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.11 117.03 0.31 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.6 t60 -151.45 90.79 1.6 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -1.151 . . . . 0.0 110.184 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.5 tp -118.04 141.31 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.218 -0.926 . . . . 0.0 110.244 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -127.09 64.47 1.31 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.256 -0.902 . . . . 0.0 110.072 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.637 HD12 ' C ' ' A' ' 7' ' ' ILE . 2.4 pp -133.93 151.69 77.25 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.28 -0.888 . . . . 0.0 110.242 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.54 125.5 10.69 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.685 1.361 . . . . 0.0 110.131 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -73.2 159.26 47.62 Favored 'Trans proline' 0 C--N 1.313 -1.335 0 O-C-N 123.468 1.246 . . . . 0.0 110.424 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 96.08 -32.91 5.96 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.85 -38.49 91.02 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -1.158 . . . . 0.0 110.204 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.5 m -53.79 -43.18 69.08 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.347 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.86 -25.34 66.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.222 -0.924 . . . . 0.0 110.367 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD21 ' HE1' ' A' ' 38' ' ' PHE . 2.6 tp -71.68 -53.07 14.73 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.206 -0.934 . . . . 0.0 110.175 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.4 mt -60.2 -44.49 95.07 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.237 -0.914 . . . . 0.0 110.08 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.48 -38.21 63.42 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.173 -0.955 . . . . 0.0 109.878 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.413 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -56.29 -57.05 21.16 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.636 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 1.8 t80 -46.65 -40.57 13.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.524 -0.986 . . . . 0.0 110.575 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.7 m -62.3 -36.57 82.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.394 -0.816 . . . . 0.0 110.267 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.9 t -79.82 -23.37 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.338 -0.851 . . . . 0.0 110.713 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 1.3 mt-10 -87.43 -54.36 4.33 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.01 -1.056 . . . . 0.0 109.246 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -54.15 -33.79 25.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.281 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 mt -78.35 -36.36 46.25 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.133 -0.98 . . . . 0.0 110.158 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -55.85 4.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.219 -0.926 . . . . 0.0 110.193 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' A' ' 27' ' ' PRO . 1.0 OUTLIER -61.18 -44.13 97.79 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.294 -0.879 . . . . 0.0 110.203 -179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.63 58.13 14.83 Favored Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.296 -0.877 . . . . 0.0 110.312 179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' A' ' 25' ' ' GLN . 45.5 Cg_endo -72.35 156.69 54.48 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.589 1.31 . . . . 0.0 110.364 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.45 -19.05 33.33 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.743 1.391 . . . . 0.0 110.509 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.13 119.36 15.61 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.256 -0.902 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -81.16 -36.25 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.136 -0.977 . . . . 0.0 110.017 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.68 -65.5 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -0.909 . . . . 0.0 109.765 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.24 -41.73 76.19 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.427 -0.795 . . . . 0.0 109.732 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -57.65 -49.23 77.17 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.344 -0.847 . . . . 0.0 109.657 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.657 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -51.93 -34.97 44.13 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.357 -0.839 . . . . 0.0 110.226 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.8 t -74.29 -53.42 17.23 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.392 0 O-C-N 121.347 -0.846 . . . . 0.0 110.427 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -57.23 -23.15 46.12 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.231 -0.918 . . . . 0.0 110.319 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 t80 -79.1 -68.31 0.67 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.266 -0.896 . . . . 0.0 110.377 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.655 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 13.1 m-85 -57.08 -45.72 83.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.237 -0.914 . . . . 0.0 110.39 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.403 ' OG1' HG13 ' B' ' 35' ' ' VAL . 83.5 m -53.57 -48.88 68.76 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.937 . . . . 0.0 110.442 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.38 -35.56 80.82 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.148 -0.97 . . . . 0.0 110.257 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.3 -43.39 67.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.0 110.27 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 -44.44 62.66 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.182 -0.949 . . . . 0.0 110.452 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.52 -31.18 65.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.263 -0.898 . . . . 0.0 109.99 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -91.9 -70.02 0.71 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.296 -0.877 . . . . 0.0 110.161 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -52.14 135.6 31.4 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.567 -0.708 . . . . 0.0 110.455 -179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.141 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.207 0.527 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -111.78 -47.82 3.12 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.277 -0.889 . . . . 0.0 110.134 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.15 117.14 0.32 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 66.4 t60 -151.67 90.5 1.56 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -1.166 . . . . 0.0 110.199 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tp -117.74 141.43 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.249 -0.907 . . . . 0.0 110.221 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -127.24 64.5 1.32 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.897 . . . . 0.0 110.079 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.637 HD12 ' C ' ' B' ' 7' ' ' ILE . 2.4 pp -133.98 151.56 76.94 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.319 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.53 125.45 10.66 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.762 1.401 . . . . 0.0 110.128 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.03 159.32 48.08 Favored 'Trans proline' 0 C--N 1.312 -1.354 0 O-C-N 123.439 1.231 . . . . 0.0 110.419 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 95.93 -32.99 5.85 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.35 90.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.284 -1.127 . . . . 0.0 110.171 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.0 m -54.03 -43.04 69.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.396 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -66.82 -25.4 66.42 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.277 -0.889 . . . . 0.0 110.317 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.493 HD21 ' HE1' ' B' ' 38' ' ' PHE . 2.5 tp -71.72 -52.85 15.63 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.242 -0.911 . . . . 0.0 110.256 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.36 -44.27 95.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.253 -0.905 . . . . 0.0 110.067 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -38.3 64.26 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.141 -0.974 . . . . 0.0 109.774 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.13 -57.18 20.4 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.642 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 1.8 t80 -46.6 -40.39 12.82 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.53 -0.982 . . . . 0.0 110.607 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -62.6 -36.29 82.26 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.437 -0.789 . . . . 0.0 110.296 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.96 -23.39 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.759 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' B' ' 17' ' ' GLY . 1.3 mt-10 -87.58 -54.18 4.41 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.056 -1.028 . . . . 0.0 109.289 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.0 t -54.18 -33.49 25.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 O-C-N 121.786 -0.571 . . . . 0.0 110.294 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' B' ' 23' ' ' LEU . 9.3 mt -78.6 -36.46 44.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.135 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.11 -55.83 4.31 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' B' ' 27' ' ' PRO . 1.0 OUTLIER -61.26 -44.01 97.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 52.6 58.1 14.88 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.319 -0.863 . . . . 0.0 110.383 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' B' ' 25' ' ' GLN . 45.9 Cg_endo -72.42 156.62 54.27 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.586 1.309 . . . . 0.0 110.498 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.27 -19.15 34.03 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.709 1.373 . . . . 0.0 110.47 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -137.16 119.19 15.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.212 -0.93 . . . . 0.0 110.236 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.98 -36.23 31.03 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.153 -0.967 . . . . 0.0 110.022 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.402 HG23 ' H ' ' B' ' 31' ' ' VAL . 41.1 t -53.62 -65.67 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.289 -0.882 . . . . 0.0 109.789 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.06 -41.71 75.48 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.52 -0.737 . . . . 0.0 109.744 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.327 -0.858 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.655 ' HB1' ' CD2' ' A' ' 38' ' ' PHE . . . -52.18 -34.89 47.14 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.348 -0.845 . . . . 0.0 110.194 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.403 HG13 ' OG1' ' A' ' 39' ' ' THR . 61.5 t -74.29 -53.51 16.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.349 -0.844 . . . . 0.0 110.452 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -57.14 -23.24 45.92 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.428 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -79.06 -68.18 0.68 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.275 -0.891 . . . . 0.0 110.438 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.657 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 13.2 m-85 -57.2 -45.75 83.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.154 -0.966 . . . . 0.0 110.414 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -53.42 -49.22 67.77 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.255 -0.903 . . . . 0.0 110.436 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.05 -35.78 81.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.155 -0.965 . . . . 0.0 110.298 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.13 -43.42 66.91 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.5 -44.55 62.56 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.293 -0.879 . . . . 0.0 110.47 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -57.42 -31.37 65.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.29 -0.881 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -91.7 -69.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.357 -0.84 . . . . 0.0 110.226 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -52.12 135.55 31.35 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.484 -0.76 . . . . 0.0 110.375 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.248 179.923 . . . . . . . . 0 0 . 1 stop_ save_