data_1und_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 1und _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 ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.69 -37.32 75.79 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.304 1.042 . . . . 0.0 110.285 175.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -54.38 -60.87 2.76 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 127.51 2.324 . . . . 0.0 107.427 171.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.4 t -51.62 -38.92 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.33 0.968 . . . . 0.0 112.513 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -62.68 -41.72 99.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.186 0.448 . . . . 0.0 111.524 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.2 t -84.53 -31.82 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.465 1.506 . . . . 0.0 112.124 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -87.23 -31.81 20.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.894 1.678 . . . . 0.0 109.717 -170.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.0 20.76 64.48 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -132.59 -168.07 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.48 157.02 23.5 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 124.948 1.299 . . . . 0.0 112.253 169.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -54.27 -38.97 66.44 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.009 172.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.58 -54.83 20.59 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -62.55 -37.6 86.76 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.075 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -62.5 -47.81 82.33 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.545 0.738 . . . . 0.0 110.131 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -19.22 65.78 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.24 -35.55 21.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.893 0.877 . . . . 0.0 111.191 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -60.6 151.71 69.82 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 123.513 0.725 . . . . 0.0 110.138 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.24 144.46 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.223 2.615 . . . . 0.0 112.524 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.92 -31.78 47.75 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.848 0.737 . . . . 0.0 112.565 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.9 p-90 -67.87 -49.95 59.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 117.747 0.773 . . . . 0.0 110.768 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.63 -34.37 75.55 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -60.2 -57.7 11.7 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 122.708 0.403 . . . . 0.0 110.527 177.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -36.69 84.86 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.878 0.471 . . . . 0.0 110.928 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -53.92 49.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 174.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 83.0 mtp -59.36 -46.01 89.82 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.876 0.762 . . . . 0.0 112.243 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -52.73 -53.13 52.09 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.037 0.38 . . . . 0.0 110.558 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -66.15 -37.76 86.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.759 0.824 . . . . 0.0 112.648 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 . . . . . 0 CA--C 1.527 0.089 0 C-N-CA 124.426 1.09 . . . . 0.0 111.534 -176.833 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.03 -32.67 71.12 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.436 0.694 . . . . 0.0 110.157 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -51.99 -56.64 13.0 Favored 'General case' 0 C--O 1.215 -0.717 0 C-N-CA 127.629 2.372 . . . . 0.0 108.13 171.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -54.97 -30.34 23.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 119.156 0.889 . . . . 0.0 111.687 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -68.25 -47.52 67.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.625 0.648 . . . . 0.0 110.898 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.2 t -77.28 -32.74 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.081 1.353 . . . . 0.0 112.138 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -87.53 -42.69 12.57 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.382 1.873 . . . . 0.0 108.614 -172.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.61 7.87 87.62 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.812 -0.994 . . . . 0.0 110.861 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.4 pt -137.1 142.33 37.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.302 1.051 . . . . 0.0 110.857 -176.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.26 162.56 28.24 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 126.346 1.859 . . . . 0.0 114.624 -175.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -44.89 54.66 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.536 2.334 . . . . 0.0 109.301 169.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.53 -54.81 31.27 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -67.98 -34.71 77.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.998 0.399 . . . . 0.0 111.527 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.96 -45.94 79.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -19.46 65.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.87 -36.99 24.94 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.591 0.756 . . . . 0.0 110.85 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.62 148.67 81.01 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 123.368 0.667 . . . . 0.0 109.888 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.34 146.38 32.46 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.356 2.704 . . . . 0.0 112.939 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -33.54 49.99 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.051 0.834 . . . . 0.0 112.682 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -65.05 -52.87 53.36 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 117.91 0.855 . . . . 0.0 110.06 173.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -62.46 -32.26 73.11 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 -174.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -61.93 -58.12 9.14 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 122.955 0.502 . . . . 0.0 110.962 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -36.39 81.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.86 0.464 . . . . 0.0 110.273 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.16 -51.62 60.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.853 1.661 . . . . 0.0 110.978 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mtp -49.96 -49.63 49.55 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.036 0.834 . . . . 0.0 111.475 175.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.8 mtpt -53.82 -48.09 70.25 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.142 0.428 . . . . 0.0 111.423 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.07 -44.76 95.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.819 0.448 . . . . 0.0 111.931 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 CA--C 1.529 0.155 0 C-N-CA 123.879 0.871 . . . . 0.0 110.734 -169.961 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.12 -36.42 72.89 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.463 0.705 . . . . 0.0 110.169 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.873 ' CZ ' ' CD2' ' A' ' 11' ' ' PHE . 3.3 t80 -51.43 -57.79 8.02 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 127.642 2.377 . . . . 0.0 107.455 172.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 t -59.27 -31.59 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-N 119.1 0.864 . . . . 0.0 111.217 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.88 -48.56 68.4 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.141 0.428 . . . . 0.0 110.52 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.8 -32.96 36.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.331 1.452 . . . . 0.0 112.072 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.873 ' CD2' ' CZ ' ' A' ' 7' ' ' PHE . 7.1 m-85 -83.65 -38.74 21.13 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 125.935 1.694 . . . . 0.0 108.296 -174.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.25 17.72 68.55 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.4 pt -150.06 143.37 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.93 158.97 26.68 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.3 ttt180 -52.54 -41.88 63.9 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.793 2.037 . . . . 0.0 110.094 169.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.31 29.09 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -65.16 -36.49 84.4 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.292 0.546 . . . . 0.0 111.085 -177.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -62.15 -48.5 79.81 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.058 0.543 . . . . 0.0 109.691 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.27 65.84 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.52 -35.57 22.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.895 0.878 . . . . 0.0 111.297 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.26 151.96 74.24 Favored Pre-proline 0 CA--C 1.536 0.419 0 C-N-CA 123.549 0.74 . . . . 0.0 110.202 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.47 146.11 43.55 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.202 2.601 . . . . 0.0 112.864 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.29 -33.93 32.26 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.439 1.018 . . . . 0.0 112.749 177.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.68 -51.44 49.59 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 117.766 0.783 . . . . 0.0 110.979 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -61.91 -33.82 74.94 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -61.92 -57.61 11.08 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.239 0.616 . . . . 0.0 110.343 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -39.26 93.48 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.7 0.4 . . . . 0.0 110.411 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -59.17 -52.9 63.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.007 0.523 . . . . 0.0 110.179 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 53.7 mmm -55.25 -44.08 75.2 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.371 0.668 . . . . 0.0 112.313 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -56.07 -51.67 67.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.374 0.533 . . . . 0.0 111.087 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -60.3 -45.35 93.66 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.858 0.463 . . . . 0.0 111.628 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 . . . . . 0 N--CA 1.456 -0.158 0 C-N-CA 124.347 1.059 . . . . 0.0 110.843 -173.061 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.76 -39.91 62.65 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.555 1.142 . . . . 0.0 111.758 172.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -52.35 -58.23 7.34 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 128.068 2.547 . . . . 0.0 107.884 174.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.28 -32.14 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 118.674 0.67 . . . . 0.0 110.998 -176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -66.28 -45.02 81.9 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.102 0.41 . . . . 0.0 110.673 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.7 t -77.79 -33.45 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.235 1.414 . . . . 0.0 111.99 -177.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -84.42 -38.57 20.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.784 1.633 . . . . 0.0 108.647 -173.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.39 16.95 70.05 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.9 pt -149.58 142.61 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.13 158.78 25.0 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -53.54 -41.01 65.98 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 126.19 1.796 . . . . 0.0 110.07 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.07 -53.62 29.0 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.84 -38.33 90.35 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.116 0.458 . . . . 0.0 111.012 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -62.31 -47.22 85.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.405 0.682 . . . . 0.0 109.875 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -19.33 65.87 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.59 -35.75 22.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.756 0.822 . . . . 0.0 111.153 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.94 153.04 67.68 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 123.852 0.861 . . . . 0.0 109.967 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.55 150.31 86.75 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.627 2.218 . . . . 0.0 111.252 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.37 -34.54 26.42 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.938 1.256 . . . . 0.0 112.853 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.7 p-90 -69.03 -49.66 55.63 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.747 0.773 . . . . 0.0 111.115 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -61.62 -35.4 77.77 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -60.68 -58.16 9.64 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 122.819 0.448 . . . . 0.0 110.202 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -39.39 92.97 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.793 0.437 . . . . 0.0 110.592 -176.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -56.34 -53.84 52.56 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.947 0.499 . . . . 0.0 109.836 175.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.7 mmm -56.84 -41.45 77.9 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.713 0.805 . . . . 0.0 112.246 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.26 -53.18 60.29 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.866 0.757 . . . . 0.0 110.838 175.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -59.76 -45.06 93.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.193 0.597 . . . . 0.0 111.49 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 . . . . . 0 CA--C 1.529 0.159 0 C-N-CA 124.601 1.16 . . . . 0.0 110.617 -172.054 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 . . . . . 0 CA--C 1.538 0.503 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.8 -33.62 66.86 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.748 1.219 . . . . 0.0 110.921 174.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -54.76 -57.1 12.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 127.375 2.27 . . . . 0.0 107.77 172.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -60.05 -33.13 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 118.807 0.731 . . . . 0.0 110.737 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 t -63.44 -48.65 76.85 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.012 0.369 . . . . 0.0 110.438 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 75.4 t -75.77 -32.94 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.584 1.154 . . . . 0.0 111.87 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.93 -24.72 28.26 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.993 1.717 . . . . 0.0 109.713 -173.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.38 28.51 20.49 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.645 1.117 . . . . 0.0 112.777 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.5 pt -144.91 141.75 23.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -66.5 159.39 27.33 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -176.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -53.95 -42.05 68.44 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 126.491 1.916 . . . . 0.0 110.19 169.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.26 -52.9 32.53 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -62.66 -40.47 97.15 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 116.972 0.386 . . . . 0.0 110.925 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.82 -49.34 78.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.353 0.661 . . . . 0.0 109.588 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -18.93 65.32 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.05 -33.86 19.38 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.006 0.922 . . . . 0.0 111.426 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.03 154.36 69.34 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 123.801 0.841 . . . . 0.0 110.571 -177.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.22 145.75 33.85 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.291 2.661 . . . . 0.0 112.653 176.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.61 -33.82 42.11 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.063 0.839 . . . . 0.0 112.658 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -67.25 -51.39 53.69 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 117.724 0.762 . . . . 0.0 110.679 175.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.02 -32.83 73.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.4 -58.85 6.54 Favored 'General case' 0 C--N 1.34 0.168 0 O-C-N 121.952 -0.467 . . . . 0.0 110.545 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.15 -38.52 89.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.661 0.384 . . . . 0.0 110.608 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -57.62 -55.63 32.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.606 1.563 . . . . 0.0 110.5 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 73.8 mmm -56.88 -44.16 81.99 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.63 0.65 . . . . 0.0 111.913 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -56.41 -52.07 66.01 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.371 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.08 -43.37 92.38 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.045 0.384 . . . . 0.0 111.443 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 . . . . . 0 N--CA 1.453 -0.286 0 C-N-CA 123.245 0.618 . . . . 0.0 111.035 -169.392 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 111.377 0.14 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.58 -37.74 65.89 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.035 1.334 . . . . 0.0 110.988 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -52.33 -57.47 9.67 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 127.407 2.283 . . . . 0.0 108.131 172.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -61.12 -31.58 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 118.359 0.527 . . . . 0.0 110.705 -176.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.0 t -64.99 -44.85 87.95 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.963 0.347 . . . . 0.0 110.658 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.1 t -79.84 -34.95 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.475 1.11 . . . . 0.0 111.786 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -79.8 -32.72 40.79 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.823 1.649 . . . . 0.0 108.775 -175.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.79 15.31 75.74 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 pt -151.86 146.57 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -175.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.22 158.2 29.47 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -53.41 -39.86 64.66 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.102 -1.863 . . . . 0.0 109.87 170.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.4 -54.28 30.48 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.177 0.894 . . . . 0.0 111.08 177.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.89 -36.15 83.43 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 117.511 0.656 . . . . 0.0 110.972 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.48 -48.64 80.88 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.421 0.689 . . . . 0.0 110.146 175.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.81 -19.29 65.77 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.83 -34.99 22.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.855 0.862 . . . . 0.0 111.351 175.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.32 153.03 61.09 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.59 0.756 . . . . 0.0 110.373 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.72 144.76 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.227 2.618 . . . . 0.0 112.735 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.54 -32.84 39.59 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.088 0.851 . . . . 0.0 112.62 177.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -68.18 -50.59 53.34 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 117.766 0.783 . . . . 0.0 110.844 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.9 -35.07 75.71 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.16 -57.95 10.61 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.695 0.398 . . . . 0.0 110.576 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -37.22 86.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.896 0.478 . . . . 0.0 110.654 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.13 -54.58 45.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.113 1.365 . . . . 0.0 110.284 177.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.0 mtp -55.61 -45.52 77.5 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 118.16 0.436 . . . . 0.0 111.603 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.36 -49.14 78.28 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 119.274 -0.394 . . . . 0.0 111.625 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -70.62 -29.24 65.57 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.538 0.608 . . . . 0.0 111.974 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 . . . . . 0 C--N 1.34 0.179 0 C-N-CA 123.937 0.895 . . . . 0.0 110.646 177.773 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.38 -37.03 76.91 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.664 0.665 . . . . 0.0 111.487 176.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -47.69 -57.53 5.41 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 126.795 2.038 . . . . 0.0 107.929 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -60.3 -31.36 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 119.184 0.902 . . . . 0.0 111.101 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 t -67.25 -45.73 75.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.157 0.435 . . . . 0.0 110.547 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.2 t -75.87 -33.69 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.257 1.423 . . . . 0.0 111.755 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -82.74 -38.23 23.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.425 1.49 . . . . 0.0 108.583 -173.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.28 18.23 67.28 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.0 pt -150.4 143.28 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.37 159.52 26.7 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -175.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -53.6 -41.29 66.47 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.832 1.653 . . . . 0.0 110.15 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.49 -53.84 29.73 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.58 -39.39 93.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.025 0.412 . . . . 0.0 110.924 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -61.31 -48.93 79.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.647 0.779 . . . . 0.0 109.834 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.4 65.91 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.15 -34.78 22.04 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.874 0.869 . . . . 0.0 111.362 175.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -60.98 152.64 69.78 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.685 0.794 . . . . 0.0 110.283 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.36 144.69 39.03 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.272 2.648 . . . . 0.0 112.588 177.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.81 -32.74 41.33 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 123.989 0.804 . . . . 0.0 112.67 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.87 -50.83 54.2 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 117.68 0.74 . . . . 0.0 110.764 174.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.0 -32.62 73.11 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -177.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -61.44 -56.65 17.85 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 122.921 0.488 . . . . 0.0 110.571 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.43 -39.66 94.26 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.431 0.292 . . . . 0.0 110.615 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -51.4 64.36 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.254 1.422 . . . . 0.0 109.814 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 60.7 mmm -61.94 -44.0 97.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.65 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -54.86 -52.25 63.4 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.644 0.656 . . . . 0.0 111.121 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.77 -48.55 80.83 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 111.652 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 . . . . . 0 N--CA 1.455 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 111.023 -173.462 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.51 -33.69 73.0 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.457 1.103 . . . . 0.0 110.733 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -53.31 -52.96 57.44 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 128.98 2.912 . . . . 0.0 108.141 171.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 t -57.21 -32.92 41.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 119.382 0.992 . . . . 0.0 111.049 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.2 t -68.55 -24.11 64.59 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.6 t -105.22 -32.54 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.889 1.675 . . . . 0.0 111.425 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -86.06 -38.82 17.42 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.94 2.096 . . . . 0.0 108.738 -175.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.89 11.59 82.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.075 -0.847 . . . . 0.0 111.155 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.3 pt -142.46 142.12 27.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 118.013 0.907 . . . . 0.0 109.45 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.99 157.92 29.59 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.99 0.9 . . . . 0.0 113.083 -176.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -52.69 -40.11 62.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 126.587 1.955 . . . . 0.0 110.063 170.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.25 -55.16 27.63 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -66.28 -37.66 85.95 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 117.288 0.544 . . . . 0.0 110.701 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -60.38 -48.94 79.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.618 0.767 . . . . 0.0 109.923 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.03 -19.27 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.59 -34.69 21.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.891 0.876 . . . . 0.0 111.317 175.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.31 152.67 71.92 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.817 0.847 . . . . 0.0 110.249 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -51.79 144.98 32.96 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.322 2.682 . . . . 0.0 112.623 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.94 -33.28 43.43 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 123.944 0.783 . . . . 0.0 112.58 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.4 p-90 -68.59 -48.95 62.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.742 0.771 . . . . 0.0 110.752 175.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -62.03 -32.98 73.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.29 -57.67 10.53 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.062 0.545 . . . . 0.0 110.533 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.71 -38.83 92.58 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.57 0.348 . . . . 0.0 110.733 -177.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -51.67 -57.13 10.07 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.283 1.433 . . . . 0.0 109.43 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 69.2 mmm -59.31 -47.05 86.87 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 111.694 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -54.19 -50.18 67.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.466 0.575 . . . . 0.0 111.525 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -60.67 -54.46 45.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.527 0.331 . . . . 0.0 111.273 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 . . . . . 0 CA--C 1.529 0.148 0 C-N-CA 124.948 1.299 . . . . 0.0 112.107 -169.876 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -57.26 -34.75 68.95 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.717 0.807 . . . . 0.0 110.161 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -53.33 -58.52 6.82 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 127.908 2.483 . . . . 0.0 107.91 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.7 t -53.84 -32.47 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 118.733 0.697 . . . . 0.0 111.826 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -66.77 -45.53 78.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.495 0.589 . . . . 0.0 110.914 177.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -80.86 -32.8 12.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 125.464 1.506 . . . . 0.0 112.342 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -88.93 -38.09 14.76 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.881 2.073 . . . . 0.0 108.862 -173.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.2 8.52 86.33 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.907 -0.941 . . . . 0.0 111.258 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.5 pt -141.95 142.75 27.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.323 0 CA-C-N 118.153 0.977 . . . . 0.0 110.493 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.45 160.22 25.39 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 125.268 1.427 . . . . 0.0 113.933 -174.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -51.08 -44.08 61.14 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.801 2.041 . . . . 0.0 109.052 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -53.56 32.16 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -64.0 -37.65 88.21 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.902 0.351 . . . . 0.0 110.995 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -66.69 -45.9 77.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -19.5 65.98 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.18 -36.71 24.47 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.647 0.779 . . . . 0.0 111.01 174.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.28 148.8 84.61 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 123.356 0.662 . . . . 0.0 110.043 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.48 145.22 47.68 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.275 2.65 . . . . 0.0 112.96 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.68 -33.03 33.56 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.296 0.951 . . . . 0.0 112.961 177.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 13.3 p-90 -68.2 -49.89 57.83 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 117.811 0.806 . . . . 0.0 111.025 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.54 -37.51 81.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -59.6 -58.28 9.29 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.556 0.342 . . . . 0.0 110.182 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -38.11 86.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.779 0.432 . . . . 0.0 110.633 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -59.9 -51.58 69.11 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.075 0.55 . . . . 0.0 110.611 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.5 mtp -54.62 -42.09 70.78 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.305 176.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.57 -52.58 64.26 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.012 0.823 . . . . 0.0 111.226 178.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -68.53 -32.49 72.47 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 . . . . . 0 C--N 1.34 0.162 0 C-N-CA 123.885 0.874 . . . . 0.0 110.75 -177.109 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.59 -40.96 80.22 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.762 0.825 . . . . 0.0 111.13 173.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.647 ' HZ ' ' CD1' ' A' ' 18' ' ' PHE . 3.3 t80 -53.1 -58.01 8.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 126.982 2.113 . . . . 0.0 107.822 171.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.3 t -58.1 -34.65 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 119.574 1.079 . . . . 0.0 111.673 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.7 t -64.4 -42.27 96.19 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.511 0.596 . . . . 0.0 111.235 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t -80.94 -35.83 14.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 124.9 1.28 . . . . 0.0 111.431 -176.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.0 -45.14 13.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.188 1.395 . . . . 0.0 109.693 -172.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.5 15.18 76.77 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.816 -0.991 . . . . 0.0 111.03 -173.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.1 pt -110.46 -160.08 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.403 0 CA-C-N 118.301 1.051 . . . . 0.0 108.305 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.65 158.13 30.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.217 1.407 . . . . 0.0 112.853 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -55.14 -39.09 69.06 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 113.12 -1.854 . . . . 0.0 110.56 170.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.99 -55.35 28.67 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.9 -42.46 99.79 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 117.053 0.427 . . . . 0.0 110.705 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.647 ' CD1' ' HZ ' ' A' ' 7' ' ' PHE . 46.8 t80 -57.02 -45.62 82.95 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.042 0.937 . . . . 0.0 111.043 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.43 -19.08 65.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.07 -28.27 22.65 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.927 0.891 . . . . 0.0 111.431 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.06 144.93 90.33 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 177.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -54.07 143.81 60.67 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.298 1.998 . . . . 0.0 111.662 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.19 -32.13 50.28 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 123.384 0.516 . . . . 0.0 112.559 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -65.93 -50.5 64.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.644 0.722 . . . . 0.0 110.676 174.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -60.88 -35.11 75.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -62.07 -54.53 40.14 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.869 0.468 . . . . 0.0 110.546 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.21 -40.58 96.36 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.044 0.538 . . . . 0.0 110.67 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -53.64 56.07 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.777 1.231 . . . . 0.0 110.544 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.1 mmm -59.28 -43.59 92.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.027 0.531 . . . . 0.0 111.233 -177.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -57.36 -49.9 74.7 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.21 -0.424 . . . . 0.0 111.21 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -70.95 -28.9 64.81 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.424 0.557 . . . . 0.0 112.414 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 . . . . . 0 C--N 1.341 0.2 0 C-N-CA 123.64 0.776 . . . . 0.0 110.167 175.974 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 . . . . . 0 CA--C 1.541 0.597 0 CA-C-O 120.325 0.107 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.5 -32.91 69.25 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.979 1.312 . . . . 0.0 111.197 173.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.0 -53.62 56.39 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 128.461 2.704 . . . . 0.0 108.204 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.5 t -53.68 -33.94 23.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.802 0.728 . . . . 0.0 111.476 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.4 t -65.94 -32.22 73.59 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.3 t -97.21 -32.68 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.646 1.578 . . . . 0.0 111.511 -174.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -87.17 -41.0 14.09 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.06 1.744 . . . . 0.0 109.179 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.31 85.02 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 119.026 -0.874 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.41 144.13 29.58 Favored 'Isoleucine or valine' 0 C--N 1.344 0.357 0 CA-C-N 118.094 0.947 . . . . 0.0 110.053 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.07 158.97 27.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.31 1.052 . . . . 0.0 113.485 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -52.19 -40.76 61.95 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.211 2.205 . . . . 0.0 110.032 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.88 -54.37 31.28 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.217 0.913 . . . . 0.0 111.142 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -59.03 -46.02 89.26 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 117.229 0.514 . . . . 0.0 110.782 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -61.67 -46.69 88.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.052 0.541 . . . . 0.0 110.405 -176.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.06 -19.32 65.81 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 178.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.12 -34.87 20.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.893 0.877 . . . . 0.0 111.22 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.1 mt -61.36 150.4 80.26 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.763 0.825 . . . . 0.0 109.907 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.0 144.86 35.23 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.329 2.686 . . . . 0.0 112.622 177.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.19 -33.02 44.67 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.882 0.753 . . . . 0.0 112.71 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.77 -50.38 57.42 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.61 0.705 . . . . 0.0 110.673 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -62.15 -33.09 73.84 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.79 -57.82 11.05 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 122.98 0.512 . . . . 0.0 110.392 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -38.56 91.63 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.55 0.34 . . . . 0.0 110.848 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.52 -54.63 38.49 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.248 1.419 . . . . 0.0 109.908 174.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -59.53 -41.7 90.6 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 118.788 -0.625 . . . . 0.0 112.268 178.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -57.33 -50.72 72.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.953 0.797 . . . . 0.0 111.019 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.72 -44.25 93.82 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.863 0.465 . . . . 0.0 112.001 176.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 . . . . . 0 CA--C 1.528 0.126 0 C-N-CA 123.842 0.857 . . . . 0.0 111.539 -174.078 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.22 -38.42 83.31 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.542 0.61 . . . . 0.0 111.51 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -49.56 -59.75 3.48 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 126.675 1.99 . . . . 0.0 107.472 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -54.23 -37.78 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.284 0.947 . . . . 0.0 112.653 177.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.7 t -64.09 -41.43 97.29 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.238 0.472 . . . . 0.0 111.453 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.4 t -83.57 -31.54 8.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.82 1.648 . . . . 0.0 111.509 -176.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.74 -38.82 19.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.863 1.265 . . . . 0.0 108.907 -170.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.04 24.04 55.94 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.2 pp -133.71 -169.83 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.06 158.21 20.62 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.609 1.164 . . . . 0.0 112.569 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -51.58 -39.49 57.97 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.365 -1.743 . . . . 0.0 110.097 170.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.31 -54.39 27.13 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.08 -45.34 87.29 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.038 0.535 . . . . 0.0 110.74 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -59.3 -46.8 87.59 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.619 0.768 . . . . 0.0 110.435 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.52 -18.65 65.48 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.42 -33.96 16.64 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.907 . . . . 0.0 111.225 175.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.07 151.2 86.83 Favored Pre-proline 0 CA--C 1.536 0.434 0 C-N-CA 123.614 0.766 . . . . 0.0 110.034 -177.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.58 144.47 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.194 2.596 . . . . 0.0 112.564 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.41 -31.92 44.1 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.001 0.81 . . . . 0.0 112.628 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -68.28 -50.39 53.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.771 0.786 . . . . 0.0 110.635 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.96 -33.14 73.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -177.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -61.03 -57.52 12.25 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 123.023 0.529 . . . . 0.0 110.319 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.56 -37.65 88.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.79 0.436 . . . . 0.0 110.926 -176.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -53.98 47.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.243 1.417 . . . . 0.0 109.543 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 62.0 mtm -62.33 -40.05 95.09 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.197 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.53 -52.25 65.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.899 0.772 . . . . 0.0 111.062 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -58.17 -47.46 83.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 175.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.285 0.634 . . . . 0.0 111.105 -169.958 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 119.688 -0.196 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.23 -38.61 77.19 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.407 0.683 . . . . 0.0 109.611 175.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.416 ' CE2' ' CD2' ' A' ' 11' ' ' PHE . 9.0 t80 -57.62 -61.11 2.74 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.855 2.062 . . . . 0.0 107.479 173.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -50.55 -38.13 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 120.09 1.314 . . . . 0.0 112.138 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 t -60.82 -35.09 75.63 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.7 t -99.06 -33.06 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 125.949 1.699 . . . . 0.0 111.99 -173.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.416 ' CD2' ' CE2' ' A' ' 7' ' ' PHE . 12.8 m-85 -90.83 -39.05 12.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.559 1.943 . . . . 0.0 109.355 -169.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.44 6.15 89.43 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.545 -1.141 . . . . 0.0 111.399 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.6 pt -123.6 140.86 45.87 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.343 1.071 . . . . 0.0 110.348 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.3 159.06 30.04 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.72 1.208 . . . . 0.0 113.455 -175.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -53.79 -39.74 65.7 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 126.575 1.95 . . . . 0.0 110.451 169.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.09 -54.88 32.98 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.173 0.892 . . . . 0.0 110.9 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -65.3 -40.31 93.64 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 117.468 0.634 . . . . 0.0 110.82 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -57.21 -48.96 77.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.678 0.791 . . . . 0.0 110.798 174.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.81 -19.69 65.79 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.33 -35.61 25.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.618 0.767 . . . . 0.0 111.0 174.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.96 147.39 90.07 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.73 145.23 50.38 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.725 2.283 . . . . 0.0 112.66 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.88 -33.04 35.08 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.165 0.888 . . . . 0.0 112.725 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.71 -50.63 56.51 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 117.672 0.736 . . . . 0.0 110.975 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.9 tptp -62.22 -34.2 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -61.36 -58.3 8.77 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.503 0.721 . . . . 0.0 110.183 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -38.79 91.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.37 0.668 . . . . 0.0 110.62 -175.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -59.31 -55.0 40.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.803 0.441 . . . . 0.0 109.999 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.6 mmm -56.19 -42.9 77.87 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.79 0.836 . . . . 0.0 112.4 -177.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -54.27 -55.11 31.46 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.578 0.351 . . . . 0.0 110.896 174.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -63.92 -33.64 76.17 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.776 0.83 . . . . 0.0 112.925 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 N--CA 1.456 -0.132 0 C-N-CA 124.19 0.996 . . . . 0.0 111.274 -175.961 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 CA--C 1.538 0.493 0 N-CA-C 111.3 0.111 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -40.22 93.34 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.687 0.795 . . . . 0.0 109.714 175.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -50.58 -62.0 1.86 Allowed 'General case' 0 C--O 1.216 -0.684 0 C-N-CA 127.727 2.411 . . . . 0.0 107.397 170.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 t -50.95 -39.16 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.577 1.081 . . . . 0.0 112.201 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -65.03 -31.34 72.52 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -101.11 -27.72 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 125.818 1.647 . . . . 0.0 111.545 -173.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -85.2 -45.62 11.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.47 1.908 . . . . 0.0 108.393 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.75 13.32 80.05 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -175.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.07 141.86 37.22 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 118.132 0.966 . . . . 0.0 109.929 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.72 161.91 27.29 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.901 1.28 . . . . 0.0 113.358 -177.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -56.36 -41.75 76.66 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.564 1.946 . . . . 0.0 108.134 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.45 -53.43 28.7 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -63.24 -38.78 92.51 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.515 0.326 . . . . 0.0 110.943 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.55 -48.15 80.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.941 0.496 . . . . 0.0 109.673 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.84 -19.67 65.99 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.88 -35.71 23.93 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.851 0.86 . . . . 0.0 111.123 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -61.2 151.51 75.63 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.588 0.755 . . . . 0.0 109.902 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -53.53 145.77 45.72 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.124 2.55 . . . . 0.0 112.939 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.11 -33.64 30.42 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 124.465 1.031 . . . . 0.0 112.853 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -68.44 -50.65 51.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 117.658 0.729 . . . . 0.0 111.049 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.75 -34.63 76.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -61.33 -57.51 12.02 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.253 0.621 . . . . 0.0 110.395 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -39.81 95.55 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.059 -176.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.27 -54.67 44.11 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.975 0.51 . . . . 0.0 110.028 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.9 mmm -54.49 -44.41 72.65 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.275 0.63 . . . . 0.0 112.153 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -56.24 -50.47 71.2 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.115 0.416 . . . . 0.0 111.779 176.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -63.05 -45.0 94.31 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 118.169 0.441 . . . . 0.0 111.973 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 . . . . . 0 N--CA 1.453 -0.31 0 C-N-CA 123.7 0.8 . . . . 0.0 111.399 -169.246 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -38.58 74.25 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.915 0.864 . . . . 0.0 111.588 173.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -51.26 -57.29 9.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 128.229 2.611 . . . . 0.0 107.761 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.8 t -53.69 -33.45 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 119.124 0.875 . . . . 0.0 112.184 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -67.81 -42.68 81.19 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.543 0.61 . . . . 0.0 111.164 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.2 t -82.13 -31.59 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 125.527 1.531 . . . . 0.0 112.229 -175.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -89.15 -40.85 12.62 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.457 1.903 . . . . 0.0 108.733 -173.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.49 10.39 83.5 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 118.997 -0.891 . . . . 0.0 111.092 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.9 pt -141.85 144.61 25.31 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 118.153 0.977 . . . . 0.0 110.149 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.12 159.75 25.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 124.852 1.261 . . . . 0.0 113.73 -175.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -53.08 -42.14 65.6 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 113.045 -1.888 . . . . 0.0 109.267 169.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.74 -54.79 28.81 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -65.71 -36.4 83.51 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 117.243 0.522 . . . . 0.0 110.957 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -63.1 -47.72 81.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.801 0.441 . . . . 0.0 110.226 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.46 -19.6 66.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 177.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.39 -36.72 24.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.681 0.793 . . . . 0.0 111.039 175.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.16 148.43 84.8 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.594 0.757 . . . . 0.0 109.621 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -52.92 145.94 38.71 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.207 2.604 . . . . 0.0 112.88 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.81 -33.66 35.68 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.301 0.953 . . . . 0.0 112.781 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -68.44 -49.73 57.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.762 0.781 . . . . 0.0 110.982 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -61.01 -36.92 80.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -59.52 -58.0 10.49 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 122.98 0.512 . . . . 0.0 110.119 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -38.2 88.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.911 0.484 . . . . 0.0 110.501 -175.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -58.43 -52.79 64.16 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 119.177 -0.439 . . . . 0.0 110.32 176.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.3 mtp -54.59 -41.06 69.47 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.293 -0.86 . . . . 0.0 112.706 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -55.55 -53.59 54.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.296 0.953 . . . . 0.0 110.669 176.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -58.82 -47.81 83.51 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.268 0.627 . . . . 0.0 111.591 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 CA--C 1.528 0.114 0 C-N-CA 125.25 1.42 . . . . 0.0 111.129 -172.868 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 . . . . . 0 CA--C 1.537 0.455 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.2 -38.84 77.53 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.884 0.874 . . . . 0.0 109.878 174.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -55.38 -58.08 9.19 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.964 2.106 . . . . 0.0 107.845 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -53.17 -36.13 24.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 120.4 1.455 . . . . 0.0 111.693 177.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.2 t -65.02 -39.38 93.3 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.558 0.617 . . . . 0.0 111.646 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.7 t -84.83 -32.82 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.539 1.536 . . . . 0.0 111.81 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -93.35 -49.52 5.9 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.404 1.881 . . . . 0.0 109.75 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.29 9.56 84.84 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.304 -1.275 . . . . 0.0 111.228 -170.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 pt -117.63 140.96 38.6 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 CA-C-N 118.814 1.307 . . . . 0.0 110.286 175.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.97 158.3 34.98 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.769 1.228 . . . . 0.0 113.649 -175.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -52.88 -39.96 63.09 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.496 2.318 . . . . 0.0 110.307 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.51 -52.85 48.43 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -65.02 -43.13 93.44 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 117.653 0.727 . . . . 0.0 110.737 -177.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.07 -48.32 73.66 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.021 0.529 . . . . 0.0 111.324 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.54 65.5 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.22 -34.19 23.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.798 0.839 . . . . 0.0 111.102 174.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 mt -61.61 144.59 92.57 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -53.42 145.22 46.97 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.813 2.342 . . . . 0.0 112.487 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.02 -33.49 36.93 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.989 0.804 . . . . 0.0 112.824 178.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.39 -49.44 63.85 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 117.562 0.681 . . . . 0.0 110.921 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.75 -37.98 83.64 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -59.35 -55.91 28.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.12 0.568 . . . . 0.0 110.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.08 -37.14 86.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.095 0.558 . . . . 0.0 110.391 -176.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -62.72 -51.94 65.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.415 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.4 mtp -54.72 -45.45 74.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.711 0.687 . . . . 0.0 112.735 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -51.04 -55.28 18.28 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.05 0.54 . . . . 0.0 110.242 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -66.09 -36.67 83.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.782 0.833 . . . . 0.0 112.68 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--N 1.339 0.14 0 C-N-CA 124.475 1.11 . . . . 0.0 110.842 -176.753 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 . . . . . 0 CA--C 1.533 0.325 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.01 -37.29 66.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.986 0.914 . . . . 0.0 110.457 173.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.27 -58.4 7.21 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 127.338 2.255 . . . . 0.0 107.287 170.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.72 -32.89 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 119.284 0.947 . . . . 0.0 111.133 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -65.64 -48.1 73.34 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.056 0.389 . . . . 0.0 110.632 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.5 t -75.0 -32.71 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.155 1.382 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -83.06 -38.02 23.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.971 1.709 . . . . 0.0 108.409 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.66 17.04 69.13 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 pt -150.8 142.11 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.35 160.91 23.64 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -176.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -52.9 -39.7 62.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 113.624 -1.625 . . . . 0.0 109.86 169.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.26 -55.52 23.18 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -58.51 -45.22 89.2 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.745 0.418 . . . . 0.0 110.967 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -60.43 -48.16 82.98 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.779 0.832 . . . . 0.0 110.245 -178.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.86 -19.52 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.81 -34.76 22.66 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.728 0.811 . . . . 0.0 111.194 175.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.68 150.78 80.71 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.566 0.746 . . . . 0.0 109.812 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -53.31 145.82 43.18 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.082 2.521 . . . . 0.0 112.876 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.43 -33.44 32.46 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.373 0.987 . . . . 0.0 112.751 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.99 -51.02 52.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.645 0.723 . . . . 0.0 110.999 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -61.95 -34.07 75.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -61.46 -57.55 11.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.302 0.641 . . . . 0.0 110.36 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -39.46 94.17 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 122.651 0.38 . . . . 0.0 110.335 -176.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -59.25 -52.04 67.39 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.086 0.554 . . . . 0.0 110.341 176.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 51.7 mmm -54.99 -44.23 74.3 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.352 0.661 . . . . 0.0 112.208 178.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -56.32 -51.03 69.74 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.395 0.543 . . . . 0.0 110.885 177.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.92 -44.51 94.26 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.015 0.526 . . . . 0.0 111.924 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.457 -0.099 0 C-N-CA 124.538 1.135 . . . . 0.0 111.002 -171.585 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 120.363 0.125 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.37 80.73 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 111.714 173.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -53.37 -53.65 48.1 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 129.135 2.974 . . . . 0.0 107.837 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 t -54.2 -31.97 22.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.162 0.892 . . . . 0.0 111.955 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.1 t -67.45 -43.9 79.97 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.321 0.51 . . . . 0.0 110.969 176.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.48 -32.95 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.85 1.66 . . . . 0.0 112.389 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -88.48 -41.26 12.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.768 2.027 . . . . 0.0 108.888 -172.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.55 11.5 81.78 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 119.085 -0.842 . . . . 0.0 111.104 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.6 pt -142.64 142.55 26.59 Favored 'Isoleucine or valine' 0 C--N 1.343 0.308 0 CA-C-N 117.945 0.873 . . . . 0.0 109.78 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.38 158.93 22.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.321 1.049 . . . . 0.0 113.58 -175.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -54.33 -41.68 69.33 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 126.201 1.8 . . . . 0.0 110.164 169.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.14 -53.74 31.57 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 177.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -63.29 -39.57 94.95 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 117.264 0.532 . . . . 0.0 110.967 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -63.02 -48.18 79.9 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.334 0.654 . . . . 0.0 109.837 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.17 -19.53 66.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.44 0.534 . . . . 0.0 112.44 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.53 -35.7 22.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.787 0.835 . . . . 0.0 111.228 175.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.2 mt -61.07 150.37 78.92 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.618 0.767 . . . . 0.0 109.774 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.03 145.44 41.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.221 2.614 . . . . 0.0 112.803 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.52 -33.3 32.9 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.275 0.94 . . . . 0.0 112.804 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -67.64 -51.19 52.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.716 0.758 . . . . 0.0 110.97 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -62.01 -34.03 75.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -61.5 -58.6 7.5 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.024 0.529 . . . . 0.0 110.05 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -38.69 90.19 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.985 0.514 . . . . 0.0 110.465 -175.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -51.07 71.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.88 0.472 . . . . 0.0 110.202 175.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mmm -57.13 -39.15 74.59 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.927 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -57.62 -53.58 56.61 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.18 0.9 . . . . 0.0 110.505 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -56.95 -46.06 82.36 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.586 0.754 . . . . 0.0 111.692 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 . . . . . 0 N--CA 1.456 -0.161 0 C-N-CA 124.516 1.126 . . . . 0.0 110.905 -171.866 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.26 72.01 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.249 1.019 . . . . 0.0 111.457 172.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.51 -58.86 4.79 Favored 'General case' 0 CA--C 1.505 -0.759 0 C-N-CA 127.557 2.343 . . . . 0.0 107.785 173.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.5 t -59.24 -32.12 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 118.761 0.71 . . . . 0.0 111.2 -177.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.8 t -66.47 -46.29 76.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.031 0.378 . . . . 0.0 110.558 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.5 t -77.29 -32.44 18.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.297 1.439 . . . . 0.0 111.981 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -84.81 -39.39 18.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.929 1.692 . . . . 0.0 108.449 -173.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.22 16.89 70.62 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.2 pt -148.9 142.83 18.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.7 158.35 24.87 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -52.77 -41.56 64.18 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.226 1.81 . . . . 0.0 110.021 169.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.67 -54.12 30.71 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.13 -36.33 83.93 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 117.451 0.625 . . . . 0.0 110.974 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -61.67 -47.36 85.7 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.156 0.583 . . . . 0.0 109.974 177.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.79 -19.12 65.77 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.23 -36.23 22.89 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.731 0.812 . . . . 0.0 111.083 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 mt -61.31 153.1 70.13 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 123.893 0.877 . . . . 0.0 109.797 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.19 150.8 87.14 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.616 2.211 . . . . 0.0 111.195 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.42 -34.12 25.96 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.915 1.245 . . . . 0.0 112.808 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -68.53 -51.16 45.99 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.712 0.756 . . . . 0.0 110.751 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -62.31 -32.49 73.25 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -61.5 -57.22 13.01 Favored 'General case' 0 C--N 1.342 0.248 0 C-N-CA 123.308 0.643 . . . . 0.0 110.664 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.17 -38.56 91.51 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 122.701 0.401 . . . . 0.0 110.663 -176.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -51.86 67.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.865 1.266 . . . . 0.0 109.958 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.9 mmm -59.32 -46.81 87.56 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.338 0.655 . . . . 0.0 111.627 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -54.58 -49.62 69.94 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.5 0.591 . . . . 0.0 111.349 177.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.3 mtmt -60.96 -47.37 86.76 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.849 0.295 . . . . 0.0 111.462 176.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 . . . . . 0 CA--C 1.527 0.087 0 C-N-CA 123.589 0.755 . . . . 0.0 111.473 -172.869 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.28 -39.03 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.87 0.868 . . . . 0.0 111.597 174.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -49.82 -56.02 11.99 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 127.298 2.239 . . . . 0.0 107.75 171.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.07 -30.73 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 119.197 0.908 . . . . 0.0 111.214 -177.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.81 -48.64 68.33 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.429 0.559 . . . . 0.0 110.232 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.1 t -73.42 -32.15 35.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 125.302 1.441 . . . . 0.0 112.023 -177.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -86.44 -23.25 26.11 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.169 1.787 . . . . 0.0 109.61 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.35 28.18 19.17 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 124.694 1.14 . . . . 0.0 112.82 -172.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 19.9 pt -145.29 143.74 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 172.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.24 158.88 27.76 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.903 0.858 . . . . 0.0 113.274 -176.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -54.67 -40.45 69.09 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.944 1.697 . . . . 0.0 109.9 170.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.6 -54.39 29.2 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.141 0.877 . . . . 0.0 110.92 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -64.35 -38.18 90.13 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 117.353 0.577 . . . . 0.0 110.859 -178.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.11 -49.66 77.02 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.611 0.764 . . . . 0.0 109.941 176.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.2 65.75 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.73 -34.07 21.31 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.93 0.892 . . . . 0.0 111.414 175.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -61.63 154.04 67.69 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.679 0.792 . . . . 0.0 110.452 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.09 144.77 36.33 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.312 2.674 . . . . 0.0 112.619 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.66 -32.78 40.34 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.014 0.816 . . . . 0.0 112.595 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -68.1 -51.47 46.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.718 0.759 . . . . 0.0 110.808 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -61.58 -32.99 73.12 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -61.78 -58.73 6.87 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.127 0.571 . . . . 0.0 110.508 176.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -37.49 86.01 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 122.721 0.408 . . . . 0.0 111.072 -176.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -54.43 47.09 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.957 1.303 . . . . 0.0 109.984 175.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.3 mmm -56.78 -43.39 80.82 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 119.159 -0.448 . . . . 0.0 111.559 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -59.7 -48.36 81.98 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 118.929 -0.558 . . . . 0.0 111.865 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.52 70.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.844 0.747 . . . . 0.0 111.722 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 109.682 -177.278 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.59 -41.09 89.47 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.217 1.008 . . . . 0.0 111.1 174.203 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.9 -52.25 61.13 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.328 3.051 . . . . 0.0 108.293 174.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -52.97 -30.99 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 119.884 1.22 . . . . 0.0 112.045 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.1 t -68.85 -46.65 67.94 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.825 0.739 . . . . 0.0 110.865 176.668 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 85.8 t -78.08 -28.61 15.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.762 1.625 . . . . 0.0 112.468 -174.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -94.31 -30.03 14.74 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 126.908 2.083 . . . . 0.0 110.146 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 50.52 26.87 10.72 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.98 0.8 . . . . 0.0 112.927 -169.704 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.12 141.31 41.93 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 CA-C-N 117.84 0.82 . . . . 0.0 109.372 169.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.39 161.32 29.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 125.007 1.323 . . . . 0.0 113.408 -176.769 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -54.22 -41.21 68.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.875 1.67 . . . . 0.0 109.762 169.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.75 -54.33 26.02 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 110.714 -0.955 . . . . 0.0 110.714 -179.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -63.44 -38.84 92.71 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.833 0.453 . . . . 0.0 111.058 -179.169 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.74 -47.73 82.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.29 0.636 . . . . 0.0 109.795 177.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.33 -19.54 66.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.74 -35.64 24.25 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.803 0.841 . . . . 0.0 110.977 175.436 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 mt -60.7 152.05 69.37 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.597 0.759 . . . . 0.0 109.682 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.78 144.22 44.64 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.977 2.451 . . . . 0.0 112.41 177.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -31.64 47.12 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 123.864 0.745 . . . . 0.0 112.509 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.0 p-90 -68.08 -50.98 51.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.668 0.734 . . . . 0.0 110.601 174.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 tptp -62.49 -31.78 72.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -176.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -62.2 -57.98 9.46 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.324 0.65 . . . . 0.0 110.58 176.155 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.58 84.53 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.886 0.475 . . . . 0.0 110.551 -176.216 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -53.08 62.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.696 1.198 . . . . 0.0 109.646 175.294 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.8 mmm -58.78 -45.34 90.06 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.945 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -53.34 -52.47 59.11 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.456 0.571 . . . . 0.0 111.134 174.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -60.39 -43.09 96.96 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.584 0.754 . . . . 0.0 111.611 178.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.122 0 C-N-CA 124.053 0.941 . . . . 0.0 110.868 -171.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.85 -37.26 63.46 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.375 1.07 . . . . 0.0 110.712 172.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -52.43 -58.7 5.89 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 127.216 2.207 . . . . 0.0 107.881 170.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -59.16 -31.99 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 118.778 0.717 . . . . 0.0 110.939 -176.81 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -65.28 -49.03 71.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.023 0.374 . . . . 0.0 110.455 177.439 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.3 t -75.16 -33.48 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.449 1.1 . . . . 0.0 111.868 -177.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -80.86 -34.71 33.54 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.054 1.742 . . . . 0.0 108.819 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.49 16.0 74.71 Favored Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 177.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.7 pt -151.31 144.9 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 -175.425 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.28 158.32 29.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.0 0.905 . . . . 0.0 113.235 -177.591 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.8 ttt180 -53.83 -39.6 65.7 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.281 1.832 . . . . 0.0 110.086 170.42 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.93 -54.84 27.99 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.07 0.843 . . . . 0.0 111.042 177.176 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.01 -36.56 84.77 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 117.437 0.619 . . . . 0.0 110.954 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -59.76 -48.86 79.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.817 0.847 . . . . 0.0 109.994 175.056 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.15 -19.38 65.95 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 178.459 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.64 -34.95 22.97 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.836 0.854 . . . . 0.0 111.353 175.193 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.04 152.89 58.81 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.57 0.748 . . . . 0.0 110.275 179.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.13 144.49 37.7 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.24 2.627 . . . . 0.0 112.514 177.552 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.17 -32.13 42.77 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 123.988 0.804 . . . . 0.0 112.496 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -68.29 -50.69 51.93 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.685 0.743 . . . . 0.0 110.734 175.157 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -61.94 -32.96 73.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.782 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -61.11 -57.69 11.47 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.883 0.473 . . . . 0.0 110.599 176.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -38.58 91.69 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.519 0.328 . . . . 0.0 110.684 -177.149 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -52.33 63.87 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.303 1.441 . . . . 0.0 109.691 175.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.2 mmm -58.7 -49.09 78.86 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.511 0.596 . . . . 0.0 111.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -57.4 -47.24 82.24 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.569 0.348 . . . . 0.0 111.268 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtmt -62.35 -44.71 95.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.852 0.461 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 C--N 1.339 0.129 0 C-N-CA 124.734 1.213 . . . . 0.0 111.588 -172.979 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.18 -39.39 86.34 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.476 0.58 . . . . 0.0 111.63 174.304 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -51.52 -61.41 2.26 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 127.171 2.188 . . . . 0.0 107.367 170.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -53.14 -38.86 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.048 0.84 . . . . 0.0 112.342 178.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.9 t -62.05 -39.78 93.53 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 117.918 0.326 . . . . 0.0 111.463 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -89.32 -30.46 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.479 1.512 . . . . 0.0 111.823 -175.132 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.77 -39.37 18.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.095 1.358 . . . . 0.0 108.815 -169.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.13 23.63 56.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.072 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -130.39 -165.6 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 172.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.03 159.17 25.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 124.939 1.296 . . . . 0.0 112.499 170.755 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -50.46 -41.17 52.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.162 2.185 . . . . 0.0 110.239 169.877 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.26 -53.83 30.63 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 179.149 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -59.81 -45.46 92.28 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.025 0.53 . . . . 0.0 110.758 178.792 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -61.41 -44.91 96.33 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.326 0.65 . . . . 0.0 110.139 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -18.44 65.33 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 178.638 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -33.83 15.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.059 0.944 . . . . 0.0 111.311 176.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -62.5 152.73 79.67 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.691 0.797 . . . . 0.0 110.668 -176.237 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -52.54 144.62 40.84 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.355 2.703 . . . . 0.0 112.544 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.34 -32.94 45.51 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.982 0.801 . . . . 0.0 112.638 178.042 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -68.67 -49.18 61.11 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.774 0.787 . . . . 0.0 110.718 175.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -61.92 -32.87 73.31 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -62.52 -58.06 8.92 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.198 0.599 . . . . 0.0 110.344 176.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 -35.79 81.79 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.798 0.439 . . . . 0.0 110.978 -177.085 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -56.27 -55.39 33.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.875 1.67 . . . . 0.0 110.096 175.336 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.6 mmm -56.24 -46.48 79.55 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.777 0.431 . . . . 0.0 110.915 177.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -56.7 -50.03 73.37 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 178.163 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -71.12 -30.97 67.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.65 0.659 . . . . 0.0 111.287 -177.108 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.164 0.585 . . . . 0.0 110.898 -177.694 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.09 -37.97 67.51 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.408 0.623 . . . . 0.0 110.085 174.498 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -49.93 -59.65 3.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 127.549 2.34 . . . . 0.0 107.958 169.927 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.2 t -58.76 -32.76 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 119.101 0.864 . . . . 0.0 110.881 -177.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.3 t -65.25 -45.43 84.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.016 0.371 . . . . 0.0 110.822 178.628 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.3 t -80.3 -33.37 14.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.376 1.07 . . . . 0.0 111.718 -176.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -79.83 -35.2 38.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.988 1.715 . . . . 0.0 108.634 -175.736 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.33 15.89 75.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 177.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.0 pt -150.28 144.01 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.165 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.95 158.43 30.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 122.102 0.953 . . . . 0.0 113.237 -176.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -52.54 -39.86 61.89 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 126.456 1.902 . . . . 0.0 110.217 169.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.03 -55.3 25.01 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.139 0.876 . . . . 0.0 111.05 177.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.14 -35.68 81.86 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 117.357 0.578 . . . . 0.0 111.042 -178.246 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -60.7 -48.38 82.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.648 0.779 . . . . 0.0 110.005 175.298 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.24 65.84 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.4 -35.13 23.33 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.834 0.854 . . . . 0.0 111.211 175.117 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.25 152.92 60.93 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 123.54 0.736 . . . . 0.0 110.339 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.61 144.51 41.9 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.225 2.617 . . . . 0.0 112.578 177.722 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.86 -32.68 41.6 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.057 0.837 . . . . 0.0 112.591 177.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -68.26 -50.39 54.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.634 0.717 . . . . 0.0 110.779 175.32 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -62.07 -33.0 73.6 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.17 -57.44 12.46 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.04 0.536 . . . . 0.0 110.71 176.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -39.4 94.22 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.545 0.338 . . . . 0.0 110.651 -177.219 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.35 55.08 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.217 1.407 . . . . 0.0 109.489 175.634 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 45.8 mmm -58.41 -47.48 83.79 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 111.58 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -55.61 -49.62 72.33 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.392 0.277 . . . . 0.0 111.404 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -64.06 -42.64 96.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 178.15 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 125.002 1.321 . . . . 0.0 112.271 -173.358 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 . . . . . 0 CA--C 1.537 0.446 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -58.84 -34.46 71.58 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.038 0.935 . . . . 0.0 110.464 173.679 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -57.92 -58.93 6.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.637 1.975 . . . . 0.0 107.205 171.53 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.99 -38.13 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 119.46 1.027 . . . . 0.0 111.965 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.2 t -61.37 -45.62 93.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.909 0.322 . . . . 0.0 111.197 178.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.79 -34.11 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.934 1.294 . . . . 0.0 111.984 -175.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -85.14 -36.25 21.2 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.524 1.53 . . . . 0.0 109.01 -170.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.83 7.4 88.04 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 178.494 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.0 pt -139.21 146.99 24.95 Favored 'Isoleucine or valine' 0 C--N 1.341 0.233 0 CA-C-N 117.786 0.793 . . . . 0.0 110.162 -177.725 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -62.54 156.91 21.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 122.174 0.988 . . . . 0.0 113.02 -177.286 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.8 ttp180 -57.39 -39.05 75.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.22 -1.809 . . . . 0.0 108.805 172.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.44 -53.18 33.8 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.352 0.977 . . . . 0.0 111.105 177.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -64.91 -36.66 85.1 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 117.815 0.807 . . . . 0.0 110.779 -178.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -60.91 -48.33 82.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.788 0.435 . . . . 0.0 110.608 176.092 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.38 65.85 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 178.026 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.62 -35.79 22.46 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.801 0.84 . . . . 0.0 111.142 175.069 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.24 150.45 79.48 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.568 0.747 . . . . 0.0 109.858 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.14 144.46 37.88 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.164 2.576 . . . . 0.0 112.493 176.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.69 -32.0 46.38 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.912 0.768 . . . . 0.0 112.608 178.122 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -67.57 -50.61 57.59 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.78 0.79 . . . . 0.0 110.612 174.463 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.04 -32.25 72.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.656 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.75 -57.54 11.51 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 122.83 0.452 . . . . 0.0 110.481 176.487 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -37.18 86.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.705 0.402 . . . . 0.0 110.873 -176.524 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -53.53 55.94 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.315 1.446 . . . . 0.0 109.451 173.979 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.9 mmm -57.66 -42.63 83.93 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.525 0.602 . . . . 0.0 111.334 178.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -57.57 -52.03 67.08 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.708 177.488 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.36 -35.32 77.56 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.313 0.506 . . . . 0.0 111.514 -176.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -175.783 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.024 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -81.74 39.7 0.56 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.86 1.264 . . . . 0.0 111.639 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -172.7 130.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.063 1.745 . . . . 0.0 108.103 -177.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 m -44.14 146.88 0.58 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.378 1.871 . . . . 0.0 111.356 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -55.19 -28.6 54.17 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.756 0.823 . . . . 0.0 111.958 -175.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.51 -46.59 15.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.509 0.723 . . . . 0.0 111.576 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.69 -37.32 75.79 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.304 1.042 . . . . 0.0 110.285 175.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -54.38 -60.87 2.76 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 127.51 2.324 . . . . 0.0 107.427 171.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.4 t -51.62 -38.92 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.33 0.968 . . . . 0.0 112.513 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -62.68 -41.72 99.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.186 0.448 . . . . 0.0 111.524 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.2 t -84.53 -31.82 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.465 1.506 . . . . 0.0 112.124 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -87.23 -31.81 20.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.894 1.678 . . . . 0.0 109.717 -170.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.0 20.76 64.48 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -132.59 -168.07 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.48 157.02 23.5 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 124.948 1.299 . . . . 0.0 112.253 169.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -54.27 -38.97 66.44 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.009 172.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.58 -54.83 20.59 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -62.55 -37.6 86.76 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.075 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -62.5 -47.81 82.33 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.545 0.738 . . . . 0.0 110.131 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -19.22 65.78 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.24 -35.55 21.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.893 0.877 . . . . 0.0 111.191 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -60.6 151.71 69.82 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 123.513 0.725 . . . . 0.0 110.138 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.24 144.46 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.223 2.615 . . . . 0.0 112.524 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.92 -31.78 47.75 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.848 0.737 . . . . 0.0 112.565 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.9 p-90 -67.87 -49.95 59.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 117.747 0.773 . . . . 0.0 110.768 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.63 -34.37 75.55 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -60.2 -57.7 11.7 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 122.708 0.403 . . . . 0.0 110.527 177.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -36.69 84.86 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.878 0.471 . . . . 0.0 110.928 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -53.92 49.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 174.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 83.0 mtp -59.36 -46.01 89.82 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.876 0.762 . . . . 0.0 112.243 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -52.73 -53.13 52.09 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.037 0.38 . . . . 0.0 110.558 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -66.15 -37.76 86.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.759 0.824 . . . . 0.0 112.648 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -60.46 -43.53 96.79 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 124.426 1.09 . . . . 0.0 111.534 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.2 mptp? -59.17 -29.46 67.47 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.95 0.341 . . . . 0.0 111.162 173.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.4 -91.58 0.13 Allowed Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -164.28 31.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.901 1.28 . . . . 0.0 111.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.9 t80 . . . . . 0 C--O 1.25 1.093 0 C-N-CA 127.403 2.281 . . . . 0.0 112.474 -174.143 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.041 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -84.09 24.6 0.92 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.612 1.165 . . . . 0.0 112.012 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -168.6 129.48 1.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.467 1.507 . . . . 0.0 108.139 -170.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.9 p -47.85 151.45 0.9 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.0 1.32 . . . . 0.0 111.059 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.67 -23.32 40.94 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -82.78 -48.09 11.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.222 1.009 . . . . 0.0 111.946 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.03 -32.67 71.12 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.436 0.694 . . . . 0.0 110.157 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -51.99 -56.64 13.0 Favored 'General case' 0 C--O 1.215 -0.717 0 C-N-CA 127.629 2.372 . . . . 0.0 108.13 171.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -54.97 -30.34 23.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 119.156 0.889 . . . . 0.0 111.687 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -68.25 -47.52 67.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.625 0.648 . . . . 0.0 110.898 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.2 t -77.28 -32.74 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.081 1.353 . . . . 0.0 112.138 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -87.53 -42.69 12.57 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.382 1.873 . . . . 0.0 108.614 -172.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.61 7.87 87.62 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.812 -0.994 . . . . 0.0 110.861 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.4 pt -137.1 142.33 37.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.302 1.051 . . . . 0.0 110.857 -176.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.26 162.56 28.24 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 126.346 1.859 . . . . 0.0 114.624 -175.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -44.89 54.66 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.536 2.334 . . . . 0.0 109.301 169.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.53 -54.81 31.27 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -67.98 -34.71 77.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.998 0.399 . . . . 0.0 111.527 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.96 -45.94 79.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -19.46 65.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.87 -36.99 24.94 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.591 0.756 . . . . 0.0 110.85 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.62 148.67 81.01 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 123.368 0.667 . . . . 0.0 109.888 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.34 146.38 32.46 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.356 2.704 . . . . 0.0 112.939 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -33.54 49.99 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.051 0.834 . . . . 0.0 112.682 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -65.05 -52.87 53.36 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 117.91 0.855 . . . . 0.0 110.06 173.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -62.46 -32.26 73.11 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 -174.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -61.93 -58.12 9.14 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 122.955 0.502 . . . . 0.0 110.962 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -36.39 81.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.86 0.464 . . . . 0.0 110.273 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.16 -51.62 60.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.853 1.661 . . . . 0.0 110.978 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mtp -49.96 -49.63 49.55 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.036 0.834 . . . . 0.0 111.475 175.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.8 mtpt -53.82 -48.09 70.25 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.142 0.428 . . . . 0.0 111.423 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.07 -44.76 95.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.819 0.448 . . . . 0.0 111.931 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -69.59 -51.7 32.8 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.879 0.871 . . . . 0.0 110.734 -169.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.22 -37.97 56.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.371 1.068 . . . . 0.0 110.758 169.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.69 -90.86 0.01 OUTLIER Glycine 0 CA--C 1.533 1.178 0 C-N-CA 124.632 1.111 . . . . 0.0 111.115 169.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -158.49 28.78 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.77 0.828 . . . . 0.0 112.683 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 t80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.696 1.198 . . . . 0.0 110.39 -179.88 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.038 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -61.97 -33.58 74.57 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.911 0.884 . . . . 0.0 112.962 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -167.89 129.56 1.47 Allowed 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 128.325 2.65 . . . . 0.0 107.542 171.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 p -49.62 154.97 0.87 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.665 1.186 . . . . 0.0 111.434 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.56 -25.01 59.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.249 0.619 . . . . 0.0 111.708 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.8 -49.77 10.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.315 1.046 . . . . 0.0 111.792 174.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.12 -36.42 72.89 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.463 0.705 . . . . 0.0 110.169 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.873 ' CZ ' ' CD2' ' A' ' 11' ' ' PHE . 3.3 t80 -51.43 -57.79 8.02 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 127.642 2.377 . . . . 0.0 107.455 172.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 t -59.27 -31.59 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-N 119.1 0.864 . . . . 0.0 111.217 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.88 -48.56 68.4 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.141 0.428 . . . . 0.0 110.52 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.8 -32.96 36.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.331 1.452 . . . . 0.0 112.072 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.873 ' CD2' ' CZ ' ' A' ' 7' ' ' PHE . 7.1 m-85 -83.65 -38.74 21.13 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 125.935 1.694 . . . . 0.0 108.296 -174.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.25 17.72 68.55 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.4 pt -150.06 143.37 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.93 158.97 26.68 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.3 ttt180 -52.54 -41.88 63.9 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.793 2.037 . . . . 0.0 110.094 169.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.31 29.09 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -65.16 -36.49 84.4 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.292 0.546 . . . . 0.0 111.085 -177.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -62.15 -48.5 79.81 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.058 0.543 . . . . 0.0 109.691 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.27 65.84 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.52 -35.57 22.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.895 0.878 . . . . 0.0 111.297 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.26 151.96 74.24 Favored Pre-proline 0 CA--C 1.536 0.419 0 C-N-CA 123.549 0.74 . . . . 0.0 110.202 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.47 146.11 43.55 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.202 2.601 . . . . 0.0 112.864 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.29 -33.93 32.26 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.439 1.018 . . . . 0.0 112.749 177.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.68 -51.44 49.59 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 117.766 0.783 . . . . 0.0 110.979 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -61.91 -33.82 74.94 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -61.92 -57.61 11.08 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.239 0.616 . . . . 0.0 110.343 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -39.26 93.48 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.7 0.4 . . . . 0.0 110.411 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -59.17 -52.9 63.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.007 0.523 . . . . 0.0 110.179 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 53.7 mmm -55.25 -44.08 75.2 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.371 0.668 . . . . 0.0 112.313 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -56.07 -51.67 67.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.374 0.533 . . . . 0.0 111.087 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -60.3 -45.35 93.66 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.858 0.463 . . . . 0.0 111.628 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.71 -55.27 21.01 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.347 1.059 . . . . 0.0 110.843 -173.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -58.02 -30.04 65.79 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.581 0.752 . . . . 0.0 110.46 173.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.3 -88.91 0.02 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.707 1.146 . . . . 0.0 110.28 168.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.3 36.17 0.2 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.599 0.76 . . . . 0.0 111.896 -173.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.106 -179.999 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.03 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -86.52 25.22 1.26 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.76 1.224 . . . . 0.0 111.655 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -175.09 130.28 0.3 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.994 2.118 . . . . 0.0 107.26 -173.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.8 m -45.39 140.85 2.88 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.351 1.461 . . . . 0.0 111.093 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.17 -26.28 16.58 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.752 1.221 . . . . 0.0 112.933 -170.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 -80.74 -49.39 11.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.843 0.857 . . . . 0.0 111.716 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.76 -39.91 62.65 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.555 1.142 . . . . 0.0 111.758 172.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -52.35 -58.23 7.34 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 128.068 2.547 . . . . 0.0 107.884 174.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.28 -32.14 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 118.674 0.67 . . . . 0.0 110.998 -176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -66.28 -45.02 81.9 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.102 0.41 . . . . 0.0 110.673 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.7 t -77.79 -33.45 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.235 1.414 . . . . 0.0 111.99 -177.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -84.42 -38.57 20.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.784 1.633 . . . . 0.0 108.647 -173.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.39 16.95 70.05 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.9 pt -149.58 142.61 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.13 158.78 25.0 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -53.54 -41.01 65.98 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 126.19 1.796 . . . . 0.0 110.07 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.07 -53.62 29.0 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.84 -38.33 90.35 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.116 0.458 . . . . 0.0 111.012 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -62.31 -47.22 85.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.405 0.682 . . . . 0.0 109.875 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -19.33 65.87 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.59 -35.75 22.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.756 0.822 . . . . 0.0 111.153 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.94 153.04 67.68 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 123.852 0.861 . . . . 0.0 109.967 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.55 150.31 86.75 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.627 2.218 . . . . 0.0 111.252 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.37 -34.54 26.42 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.938 1.256 . . . . 0.0 112.853 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.7 p-90 -69.03 -49.66 55.63 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.747 0.773 . . . . 0.0 111.115 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -61.62 -35.4 77.77 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -60.68 -58.16 9.64 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 122.819 0.448 . . . . 0.0 110.202 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -39.39 92.97 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.793 0.437 . . . . 0.0 110.592 -176.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -56.34 -53.84 52.56 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.947 0.499 . . . . 0.0 109.836 175.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.7 mmm -56.84 -41.45 77.9 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.713 0.805 . . . . 0.0 112.246 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.26 -53.18 60.29 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.866 0.757 . . . . 0.0 110.838 175.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -59.76 -45.06 93.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.193 0.597 . . . . 0.0 111.49 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -67.23 -52.93 34.99 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.601 1.16 . . . . 0.0 110.617 -172.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -60.76 -28.56 68.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.093 0.557 . . . . 0.0 110.532 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.31 -89.97 0.02 OUTLIER Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.769 1.176 . . . . 0.0 110.407 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -165.16 29.82 0.06 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.842 0.857 . . . . 0.0 111.824 -174.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.1 t80 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 117.2 -1.381 . . . . 0.0 110.206 -177.002 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.012 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -86.75 23.99 1.57 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.614 1.166 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -174.24 130.68 0.38 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.628 1.971 . . . . 0.0 107.528 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 m -44.19 141.84 1.66 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.323 1.449 . . . . 0.0 111.032 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.85 -23.89 33.45 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.19 0.996 . . . . 0.0 113.005 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -81.11 -49.96 10.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.968 0.907 . . . . 0.0 111.701 173.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.8 -33.62 66.86 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.748 1.219 . . . . 0.0 110.921 174.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -54.76 -57.1 12.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 127.375 2.27 . . . . 0.0 107.77 172.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -60.05 -33.13 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 118.807 0.731 . . . . 0.0 110.737 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 t -63.44 -48.65 76.85 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.012 0.369 . . . . 0.0 110.438 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 75.4 t -75.77 -32.94 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.584 1.154 . . . . 0.0 111.87 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.93 -24.72 28.26 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.993 1.717 . . . . 0.0 109.713 -173.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.38 28.51 20.49 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.645 1.117 . . . . 0.0 112.777 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.5 pt -144.91 141.75 23.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -66.5 159.39 27.33 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -176.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -53.95 -42.05 68.44 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 126.491 1.916 . . . . 0.0 110.19 169.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.26 -52.9 32.53 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -62.66 -40.47 97.15 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 116.972 0.386 . . . . 0.0 110.925 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.82 -49.34 78.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.353 0.661 . . . . 0.0 109.588 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -18.93 65.32 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.05 -33.86 19.38 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.006 0.922 . . . . 0.0 111.426 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.03 154.36 69.34 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 123.801 0.841 . . . . 0.0 110.571 -177.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.22 145.75 33.85 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.291 2.661 . . . . 0.0 112.653 176.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.61 -33.82 42.11 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.063 0.839 . . . . 0.0 112.658 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -67.25 -51.39 53.69 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 117.724 0.762 . . . . 0.0 110.679 175.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.02 -32.83 73.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.4 -58.85 6.54 Favored 'General case' 0 C--N 1.34 0.168 0 O-C-N 121.952 -0.467 . . . . 0.0 110.545 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.15 -38.52 89.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.661 0.384 . . . . 0.0 110.608 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -57.62 -55.63 32.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.606 1.563 . . . . 0.0 110.5 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 73.8 mmm -56.88 -44.16 81.99 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.63 0.65 . . . . 0.0 111.913 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -56.41 -52.07 66.01 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.371 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.08 -43.37 92.38 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.045 0.384 . . . . 0.0 111.443 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -69.19 -46.65 66.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.245 0.618 . . . . 0.0 111.035 -169.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -27.55 68.54 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.307 0.243 . . . . 0.0 110.35 173.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.1 -89.86 0.04 OUTLIER Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.027 1.299 . . . . 0.0 111.392 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -156.16 41.8 0.38 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.356 1.462 . . . . 0.0 110.629 -170.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.8 t80 . . . . . 0 C--O 1.251 1.174 0 C-N-CA 128.927 2.891 . . . . 0.0 111.068 -178.496 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.025 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 49.8 p90 -81.84 31.22 0.37 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.95 1.3 . . . . 0.0 111.924 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -170.03 130.58 0.98 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.84 2.056 . . . . 0.0 106.525 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 m -44.94 138.11 3.77 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.809 1.244 . . . . 0.0 110.173 -175.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -59.06 -20.19 51.09 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -81.86 -49.27 10.54 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.873 0.869 . . . . 0.0 111.377 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.58 -37.74 65.89 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.035 1.334 . . . . 0.0 110.988 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -52.33 -57.47 9.67 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 127.407 2.283 . . . . 0.0 108.131 172.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -61.12 -31.58 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 118.359 0.527 . . . . 0.0 110.705 -176.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.0 t -64.99 -44.85 87.95 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.963 0.347 . . . . 0.0 110.658 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.1 t -79.84 -34.95 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.475 1.11 . . . . 0.0 111.786 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -79.8 -32.72 40.79 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.823 1.649 . . . . 0.0 108.775 -175.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.79 15.31 75.74 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 pt -151.86 146.57 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -175.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.22 158.2 29.47 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -53.41 -39.86 64.66 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.102 -1.863 . . . . 0.0 109.87 170.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.4 -54.28 30.48 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.177 0.894 . . . . 0.0 111.08 177.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.89 -36.15 83.43 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 117.511 0.656 . . . . 0.0 110.972 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.48 -48.64 80.88 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.421 0.689 . . . . 0.0 110.146 175.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.81 -19.29 65.77 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.83 -34.99 22.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.855 0.862 . . . . 0.0 111.351 175.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.32 153.03 61.09 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.59 0.756 . . . . 0.0 110.373 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.72 144.76 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.227 2.618 . . . . 0.0 112.735 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.54 -32.84 39.59 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.088 0.851 . . . . 0.0 112.62 177.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -68.18 -50.59 53.34 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 117.766 0.783 . . . . 0.0 110.844 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.9 -35.07 75.71 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.16 -57.95 10.61 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.695 0.398 . . . . 0.0 110.576 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -37.22 86.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.896 0.478 . . . . 0.0 110.654 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.13 -54.58 45.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.113 1.365 . . . . 0.0 110.284 177.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.0 mtp -55.61 -45.52 77.5 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 118.16 0.436 . . . . 0.0 111.603 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.36 -49.14 78.28 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 119.274 -0.394 . . . . 0.0 111.625 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -70.62 -29.24 65.57 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.538 0.608 . . . . 0.0 111.974 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -68.63 -50.6 50.08 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.937 0.895 . . . . 0.0 110.646 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -58.04 -29.3 65.25 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.613 0.365 . . . . 0.0 110.778 169.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.74 -91.83 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.387 0.994 . . . . 0.0 110.621 169.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -166.14 24.85 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.417 0.687 . . . . 0.0 112.424 -175.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 t80 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.441 -1.266 . . . . 0.0 109.436 -175.17 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.015 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -152.55 111.67 3.84 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.958 0.903 . . . . 0.0 108.75 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.0 mp 52.88 85.61 0.05 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.647 1.579 . . . . 0.0 112.943 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 p -68.15 149.63 49.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 168.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.02 -25.28 60.93 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.306 0.242 . . . . 0.0 111.514 -174.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -81.49 -50.76 9.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.233 1.013 . . . . 0.0 112.505 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.38 -37.03 76.91 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.664 0.665 . . . . 0.0 111.487 176.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -47.69 -57.53 5.41 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 126.795 2.038 . . . . 0.0 107.929 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -60.3 -31.36 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 119.184 0.902 . . . . 0.0 111.101 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 t -67.25 -45.73 75.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.157 0.435 . . . . 0.0 110.547 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.2 t -75.87 -33.69 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.257 1.423 . . . . 0.0 111.755 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -82.74 -38.23 23.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.425 1.49 . . . . 0.0 108.583 -173.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.28 18.23 67.28 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.0 pt -150.4 143.28 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.37 159.52 26.7 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -175.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -53.6 -41.29 66.47 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.832 1.653 . . . . 0.0 110.15 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.49 -53.84 29.73 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.58 -39.39 93.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.025 0.412 . . . . 0.0 110.924 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -61.31 -48.93 79.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.647 0.779 . . . . 0.0 109.834 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.4 65.91 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.15 -34.78 22.04 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.874 0.869 . . . . 0.0 111.362 175.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -60.98 152.64 69.78 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.685 0.794 . . . . 0.0 110.283 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.36 144.69 39.03 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.272 2.648 . . . . 0.0 112.588 177.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.81 -32.74 41.33 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 123.989 0.804 . . . . 0.0 112.67 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.87 -50.83 54.2 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 117.68 0.74 . . . . 0.0 110.764 174.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.0 -32.62 73.11 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -177.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -61.44 -56.65 17.85 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 122.921 0.488 . . . . 0.0 110.571 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.43 -39.66 94.26 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.431 0.292 . . . . 0.0 110.615 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -51.4 64.36 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.254 1.422 . . . . 0.0 109.814 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 60.7 mmm -61.94 -44.0 97.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.65 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -54.86 -52.25 63.4 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.644 0.656 . . . . 0.0 111.121 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.77 -48.55 80.83 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 111.652 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 -65.67 -53.91 34.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 111.023 -173.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -58.05 -31.04 66.65 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.355 0.525 . . . . 0.0 110.771 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.72 -89.42 0.02 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.76 1.172 . . . . 0.0 110.94 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -93.43 42.35 1.1 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.961 1.304 . . . . 0.0 112.707 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.3 p90 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 124.632 1.173 . . . . 0.0 113.084 169.813 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.06 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 14.0 t80 59.73 -154.06 0.37 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.864 1.266 . . . . 0.0 110.431 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -164.83 127.97 2.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.701 1.6 . . . . 0.0 107.795 -175.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.4 m -50.35 148.4 3.67 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.282 1.433 . . . . 0.0 110.548 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -60.43 -16.11 32.96 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -174.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -80.45 -50.61 9.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 111.426 170.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.51 -33.69 73.0 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.457 1.103 . . . . 0.0 110.733 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -53.31 -52.96 57.44 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 128.98 2.912 . . . . 0.0 108.141 171.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 t -57.21 -32.92 41.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 119.382 0.992 . . . . 0.0 111.049 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.2 t -68.55 -24.11 64.59 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.6 t -105.22 -32.54 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.889 1.675 . . . . 0.0 111.425 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -86.06 -38.82 17.42 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.94 2.096 . . . . 0.0 108.738 -175.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.89 11.59 82.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.075 -0.847 . . . . 0.0 111.155 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.3 pt -142.46 142.12 27.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 118.013 0.907 . . . . 0.0 109.45 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.99 157.92 29.59 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.99 0.9 . . . . 0.0 113.083 -176.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -52.69 -40.11 62.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 126.587 1.955 . . . . 0.0 110.063 170.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.25 -55.16 27.63 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -66.28 -37.66 85.95 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 117.288 0.544 . . . . 0.0 110.701 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -60.38 -48.94 79.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.618 0.767 . . . . 0.0 109.923 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.03 -19.27 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.59 -34.69 21.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.891 0.876 . . . . 0.0 111.317 175.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.31 152.67 71.92 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.817 0.847 . . . . 0.0 110.249 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -51.79 144.98 32.96 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.322 2.682 . . . . 0.0 112.623 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.94 -33.28 43.43 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 123.944 0.783 . . . . 0.0 112.58 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.4 p-90 -68.59 -48.95 62.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.742 0.771 . . . . 0.0 110.752 175.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -62.03 -32.98 73.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.29 -57.67 10.53 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.062 0.545 . . . . 0.0 110.533 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.71 -38.83 92.58 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.57 0.348 . . . . 0.0 110.733 -177.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -51.67 -57.13 10.07 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.283 1.433 . . . . 0.0 109.43 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 69.2 mmm -59.31 -47.05 86.87 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 111.694 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -54.19 -50.18 67.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.466 0.575 . . . . 0.0 111.525 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -60.67 -54.46 45.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.527 0.331 . . . . 0.0 111.273 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -60.7 -47.14 87.59 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.948 1.299 . . . . 0.0 112.107 -169.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -29.79 69.36 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.674 0.39 . . . . 0.0 110.555 175.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.93 -89.72 0.06 OUTLIER Glycine 0 CA--C 1.532 1.107 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -158.0 24.91 0.26 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.92 1.288 . . . . 0.0 111.055 -177.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 125.914 1.686 . . . . 0.0 109.925 -169.523 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.008 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -86.35 23.12 1.65 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.547 1.139 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -172.29 129.96 0.59 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.556 1.942 . . . . 0.0 107.554 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.6 p -49.57 148.76 2.68 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.737 0.815 . . . . 0.0 110.447 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -62.02 -15.53 44.98 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -81.64 -50.71 9.0 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.43 1.092 . . . . 0.0 111.774 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -57.26 -34.75 68.95 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.717 0.807 . . . . 0.0 110.161 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -53.33 -58.52 6.82 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 127.908 2.483 . . . . 0.0 107.91 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.7 t -53.84 -32.47 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 118.733 0.697 . . . . 0.0 111.826 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -66.77 -45.53 78.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.495 0.589 . . . . 0.0 110.914 177.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -80.86 -32.8 12.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 125.464 1.506 . . . . 0.0 112.342 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -88.93 -38.09 14.76 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.881 2.073 . . . . 0.0 108.862 -173.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.2 8.52 86.33 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.907 -0.941 . . . . 0.0 111.258 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.5 pt -141.95 142.75 27.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.323 0 CA-C-N 118.153 0.977 . . . . 0.0 110.493 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.45 160.22 25.39 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 125.268 1.427 . . . . 0.0 113.933 -174.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -51.08 -44.08 61.14 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.801 2.041 . . . . 0.0 109.052 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -53.56 32.16 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -64.0 -37.65 88.21 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.902 0.351 . . . . 0.0 110.995 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -66.69 -45.9 77.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -19.5 65.98 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.18 -36.71 24.47 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.647 0.779 . . . . 0.0 111.01 174.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.28 148.8 84.61 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 123.356 0.662 . . . . 0.0 110.043 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.48 145.22 47.68 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.275 2.65 . . . . 0.0 112.96 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.68 -33.03 33.56 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.296 0.951 . . . . 0.0 112.961 177.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 13.3 p-90 -68.2 -49.89 57.83 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 117.811 0.806 . . . . 0.0 111.025 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.54 -37.51 81.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -59.6 -58.28 9.29 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.556 0.342 . . . . 0.0 110.182 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -38.11 86.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.779 0.432 . . . . 0.0 110.633 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -59.9 -51.58 69.11 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.075 0.55 . . . . 0.0 110.611 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.5 mtp -54.62 -42.09 70.78 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.305 176.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.57 -52.58 64.26 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.012 0.823 . . . . 0.0 111.226 178.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -68.53 -32.49 72.47 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.36 -54.67 8.77 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.885 0.874 . . . . 0.0 110.75 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -59.87 -28.56 67.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.134 0.573 . . . . 0.0 110.058 172.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.89 -90.12 0.01 OUTLIER Glycine 0 CA--C 1.528 0.906 0 C-N-CA 125.413 1.483 . . . . 0.0 110.607 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.47 27.97 0.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -173.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.3 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.793 179.359 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.133 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -57.99 114.74 2.48 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.876 0.87 . . . . 0.0 109.698 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.1 mp 51.0 69.46 0.64 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.106 1.363 . . . . 0.0 110.812 -174.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 74.8 m -60.76 134.62 57.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 168.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -46.94 -33.27 4.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.209 1.404 . . . . 0.0 112.695 -169.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 -79.57 -46.35 17.47 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.314 0.646 . . . . 0.0 112.108 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.59 -40.96 80.22 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.762 0.825 . . . . 0.0 111.13 173.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.647 ' HZ ' ' CD1' ' A' ' 18' ' ' PHE . 3.3 t80 -53.1 -58.01 8.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 126.982 2.113 . . . . 0.0 107.822 171.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.3 t -58.1 -34.65 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 119.574 1.079 . . . . 0.0 111.673 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.7 t -64.4 -42.27 96.19 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.511 0.596 . . . . 0.0 111.235 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t -80.94 -35.83 14.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 124.9 1.28 . . . . 0.0 111.431 -176.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.0 -45.14 13.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.188 1.395 . . . . 0.0 109.693 -172.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.5 15.18 76.77 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.816 -0.991 . . . . 0.0 111.03 -173.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.1 pt -110.46 -160.08 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.403 0 CA-C-N 118.301 1.051 . . . . 0.0 108.305 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.65 158.13 30.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.217 1.407 . . . . 0.0 112.853 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -55.14 -39.09 69.06 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 113.12 -1.854 . . . . 0.0 110.56 170.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.99 -55.35 28.67 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.9 -42.46 99.79 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 117.053 0.427 . . . . 0.0 110.705 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.647 ' CD1' ' HZ ' ' A' ' 7' ' ' PHE . 46.8 t80 -57.02 -45.62 82.95 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.042 0.937 . . . . 0.0 111.043 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.43 -19.08 65.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.07 -28.27 22.65 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.927 0.891 . . . . 0.0 111.431 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.06 144.93 90.33 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 177.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -54.07 143.81 60.67 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.298 1.998 . . . . 0.0 111.662 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.19 -32.13 50.28 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 123.384 0.516 . . . . 0.0 112.559 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -65.93 -50.5 64.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.644 0.722 . . . . 0.0 110.676 174.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -60.88 -35.11 75.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -62.07 -54.53 40.14 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.869 0.468 . . . . 0.0 110.546 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.21 -40.58 96.36 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.044 0.538 . . . . 0.0 110.67 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -53.64 56.07 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.777 1.231 . . . . 0.0 110.544 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.1 mmm -59.28 -43.59 92.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.027 0.531 . . . . 0.0 111.233 -177.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -57.36 -49.9 74.7 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.21 -0.424 . . . . 0.0 111.21 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -70.95 -28.9 64.81 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.424 0.557 . . . . 0.0 112.414 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.72 -51.37 59.84 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.64 0.776 . . . . 0.0 110.167 175.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -58.36 -28.72 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.762 0.425 . . . . 0.0 110.545 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.53 -91.16 0.02 OUTLIER Glycine 0 CA--C 1.53 1.031 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 169.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -164.47 24.53 0.07 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.547 0.739 . . . . 0.0 112.359 -176.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 117.007 -1.473 . . . . 0.0 110.605 -178.857 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.029 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -86.88 25.06 1.36 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.594 1.157 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -174.7 130.08 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.254 2.222 . . . . 0.0 106.895 -173.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m -47.41 137.69 8.33 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.755 1.222 . . . . 0.0 110.087 -177.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -60.04 -16.7 33.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -80.62 -49.13 11.67 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.495 0.718 . . . . 0.0 111.043 170.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.5 -32.91 69.25 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.979 1.312 . . . . 0.0 111.197 173.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.0 -53.62 56.39 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 128.461 2.704 . . . . 0.0 108.204 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.5 t -53.68 -33.94 23.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.802 0.728 . . . . 0.0 111.476 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.4 t -65.94 -32.22 73.59 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.3 t -97.21 -32.68 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.646 1.578 . . . . 0.0 111.511 -174.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -87.17 -41.0 14.09 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.06 1.744 . . . . 0.0 109.179 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.31 85.02 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 119.026 -0.874 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.41 144.13 29.58 Favored 'Isoleucine or valine' 0 C--N 1.344 0.357 0 CA-C-N 118.094 0.947 . . . . 0.0 110.053 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.07 158.97 27.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.31 1.052 . . . . 0.0 113.485 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -52.19 -40.76 61.95 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.211 2.205 . . . . 0.0 110.032 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.88 -54.37 31.28 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.217 0.913 . . . . 0.0 111.142 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -59.03 -46.02 89.26 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 117.229 0.514 . . . . 0.0 110.782 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -61.67 -46.69 88.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.052 0.541 . . . . 0.0 110.405 -176.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.06 -19.32 65.81 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 178.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.12 -34.87 20.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.893 0.877 . . . . 0.0 111.22 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.1 mt -61.36 150.4 80.26 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.763 0.825 . . . . 0.0 109.907 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.0 144.86 35.23 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.329 2.686 . . . . 0.0 112.622 177.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.19 -33.02 44.67 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.882 0.753 . . . . 0.0 112.71 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.77 -50.38 57.42 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.61 0.705 . . . . 0.0 110.673 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -62.15 -33.09 73.84 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.79 -57.82 11.05 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 122.98 0.512 . . . . 0.0 110.392 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -38.56 91.63 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.55 0.34 . . . . 0.0 110.848 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.52 -54.63 38.49 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.248 1.419 . . . . 0.0 109.908 174.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -59.53 -41.7 90.6 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 118.788 -0.625 . . . . 0.0 112.268 178.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -57.33 -50.72 72.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.953 0.797 . . . . 0.0 111.019 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.72 -44.25 93.82 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.863 0.465 . . . . 0.0 112.001 176.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -67.39 -54.14 23.1 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.842 0.857 . . . . 0.0 111.539 -174.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -57.68 -28.7 64.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.605 0.762 . . . . 0.0 110.448 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.66 -91.32 0.02 OUTLIER Glycine 0 CA--C 1.531 1.063 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 169.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -166.72 26.96 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.945 0.898 . . . . 0.0 112.248 -176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.6 t80 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.822 -176.193 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.005 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.51 176.17 5.65 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.584 0.753 . . . . 0.0 111.887 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.0 mp 55.25 85.19 0.07 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 84.4 p -64.77 146.72 54.42 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -55.34 -28.38 53.4 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.571 0.748 . . . . 0.0 111.605 -173.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.93 -48.2 12.65 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.96 0.904 . . . . 0.0 112.467 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.22 -38.42 83.31 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.542 0.61 . . . . 0.0 111.51 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -49.56 -59.75 3.48 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 126.675 1.99 . . . . 0.0 107.472 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -54.23 -37.78 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.284 0.947 . . . . 0.0 112.653 177.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.7 t -64.09 -41.43 97.29 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.238 0.472 . . . . 0.0 111.453 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.4 t -83.57 -31.54 8.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.82 1.648 . . . . 0.0 111.509 -176.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.74 -38.82 19.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.863 1.265 . . . . 0.0 108.907 -170.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.04 24.04 55.94 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.2 pp -133.71 -169.83 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.06 158.21 20.62 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.609 1.164 . . . . 0.0 112.569 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -51.58 -39.49 57.97 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.365 -1.743 . . . . 0.0 110.097 170.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.31 -54.39 27.13 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.08 -45.34 87.29 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.038 0.535 . . . . 0.0 110.74 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -59.3 -46.8 87.59 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.619 0.768 . . . . 0.0 110.435 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.52 -18.65 65.48 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.42 -33.96 16.64 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.907 . . . . 0.0 111.225 175.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.07 151.2 86.83 Favored Pre-proline 0 CA--C 1.536 0.434 0 C-N-CA 123.614 0.766 . . . . 0.0 110.034 -177.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.58 144.47 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.194 2.596 . . . . 0.0 112.564 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.41 -31.92 44.1 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.001 0.81 . . . . 0.0 112.628 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -68.28 -50.39 53.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.771 0.786 . . . . 0.0 110.635 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.96 -33.14 73.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -177.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -61.03 -57.52 12.25 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 123.023 0.529 . . . . 0.0 110.319 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.56 -37.65 88.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.79 0.436 . . . . 0.0 110.926 -176.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -53.98 47.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.243 1.417 . . . . 0.0 109.543 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 62.0 mtm -62.33 -40.05 95.09 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.197 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.53 -52.25 65.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.899 0.772 . . . . 0.0 111.062 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -58.17 -47.46 83.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 175.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -66.2 -52.69 45.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.285 0.634 . . . . 0.0 111.105 -169.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -60.81 -32.2 71.57 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.309 174.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.3 -89.17 0.02 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 124.909 1.243 . . . . 0.0 111.746 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.79 42.35 0.21 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.069 1.348 . . . . 0.0 110.325 -169.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.4 t80 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 129.172 2.989 . . . . 0.0 111.006 -177.888 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.021 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -65.95 107.36 1.83 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.618 0.767 . . . . 0.0 109.582 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.8 mp 59.28 94.41 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.817 1.647 . . . . 0.0 111.805 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.4 p -58.78 147.29 33.9 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -58.49 -25.32 62.22 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -79.33 -48.54 13.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.21 0.604 . . . . 0.0 111.188 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.23 -38.61 77.19 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.407 0.683 . . . . 0.0 109.611 175.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.416 ' CE2' ' CD2' ' A' ' 11' ' ' PHE . 9.0 t80 -57.62 -61.11 2.74 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.855 2.062 . . . . 0.0 107.479 173.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -50.55 -38.13 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 120.09 1.314 . . . . 0.0 112.138 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 t -60.82 -35.09 75.63 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.7 t -99.06 -33.06 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 125.949 1.699 . . . . 0.0 111.99 -173.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.416 ' CD2' ' CE2' ' A' ' 7' ' ' PHE . 12.8 m-85 -90.83 -39.05 12.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.559 1.943 . . . . 0.0 109.355 -169.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.44 6.15 89.43 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.545 -1.141 . . . . 0.0 111.399 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.6 pt -123.6 140.86 45.87 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.343 1.071 . . . . 0.0 110.348 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.3 159.06 30.04 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.72 1.208 . . . . 0.0 113.455 -175.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -53.79 -39.74 65.7 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 126.575 1.95 . . . . 0.0 110.451 169.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.09 -54.88 32.98 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.173 0.892 . . . . 0.0 110.9 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -65.3 -40.31 93.64 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 117.468 0.634 . . . . 0.0 110.82 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -57.21 -48.96 77.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.678 0.791 . . . . 0.0 110.798 174.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.81 -19.69 65.79 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.33 -35.61 25.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.618 0.767 . . . . 0.0 111.0 174.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.96 147.39 90.07 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.73 145.23 50.38 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.725 2.283 . . . . 0.0 112.66 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.88 -33.04 35.08 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.165 0.888 . . . . 0.0 112.725 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.71 -50.63 56.51 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 117.672 0.736 . . . . 0.0 110.975 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.9 tptp -62.22 -34.2 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -61.36 -58.3 8.77 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.503 0.721 . . . . 0.0 110.183 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -38.79 91.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.37 0.668 . . . . 0.0 110.62 -175.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -59.31 -55.0 40.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.803 0.441 . . . . 0.0 109.999 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.6 mmm -56.19 -42.9 77.87 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.79 0.836 . . . . 0.0 112.4 -177.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -54.27 -55.11 31.46 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.578 0.351 . . . . 0.0 110.896 174.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -63.92 -33.64 76.17 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.776 0.83 . . . . 0.0 112.925 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.99 -48.19 72.02 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 124.19 0.996 . . . . 0.0 111.274 -175.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -58.79 -29.09 66.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.255 0.48 . . . . 0.0 111.263 170.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.88 -91.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.958 0 N-CA-C 109.754 -1.338 . . . . 0.0 109.754 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -167.35 24.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.712 0.805 . . . . 0.0 112.087 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.041 -0.981 . . . . 0.0 109.496 -172.836 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.02 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -69.5 105.02 2.49 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.49 0.716 . . . . 0.0 109.476 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.4 mp 58.96 93.03 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.563 1.545 . . . . 0.0 112.714 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.0 p -64.88 140.62 58.89 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 169.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -59.77 -19.65 51.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -169.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -79.81 -47.78 14.62 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.504 0.722 . . . . 0.0 111.3 175.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -40.22 93.34 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.687 0.795 . . . . 0.0 109.714 175.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -50.58 -62.0 1.86 Allowed 'General case' 0 C--O 1.216 -0.684 0 C-N-CA 127.727 2.411 . . . . 0.0 107.397 170.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 t -50.95 -39.16 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.577 1.081 . . . . 0.0 112.201 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -65.03 -31.34 72.52 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -101.11 -27.72 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 125.818 1.647 . . . . 0.0 111.545 -173.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -85.2 -45.62 11.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.47 1.908 . . . . 0.0 108.393 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.75 13.32 80.05 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -175.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.07 141.86 37.22 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 118.132 0.966 . . . . 0.0 109.929 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.72 161.91 27.29 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.901 1.28 . . . . 0.0 113.358 -177.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -56.36 -41.75 76.66 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.564 1.946 . . . . 0.0 108.134 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.45 -53.43 28.7 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -63.24 -38.78 92.51 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.515 0.326 . . . . 0.0 110.943 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.55 -48.15 80.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.941 0.496 . . . . 0.0 109.673 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.84 -19.67 65.99 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.88 -35.71 23.93 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.851 0.86 . . . . 0.0 111.123 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -61.2 151.51 75.63 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.588 0.755 . . . . 0.0 109.902 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -53.53 145.77 45.72 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.124 2.55 . . . . 0.0 112.939 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.11 -33.64 30.42 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 124.465 1.031 . . . . 0.0 112.853 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -68.44 -50.65 51.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 117.658 0.729 . . . . 0.0 111.049 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.75 -34.63 76.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -61.33 -57.51 12.02 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.253 0.621 . . . . 0.0 110.395 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -39.81 95.55 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.059 -176.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.27 -54.67 44.11 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.975 0.51 . . . . 0.0 110.028 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.9 mmm -54.49 -44.41 72.65 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.275 0.63 . . . . 0.0 112.153 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -56.24 -50.47 71.2 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.115 0.416 . . . . 0.0 111.779 176.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -63.05 -45.0 94.31 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 118.169 0.441 . . . . 0.0 111.973 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -68.08 -49.39 61.6 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.7 0.8 . . . . 0.0 111.399 -169.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -64.12 -29.68 70.8 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.23 0.212 . . . . 0.0 110.479 173.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.61 -89.66 0.02 OUTLIER Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.869 1.223 . . . . 0.0 111.614 169.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.87 41.23 0.28 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.296 1.438 . . . . 0.0 110.562 -169.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.4 t80 . . . . . 0 C--O 1.25 1.105 0 C-N-CA 128.633 2.773 . . . . 0.0 110.917 -177.344 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.033 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.3 p90 -86.94 24.31 1.54 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.606 1.163 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -174.21 129.81 0.37 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 106.963 -173.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 94.6 p -51.06 148.55 4.29 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.962 0.905 . . . . 0.0 110.89 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -53.75 -27.55 29.3 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.603 1.561 . . . . 0.0 112.008 -172.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -80.01 -50.02 10.98 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.985 0.914 . . . . 0.0 112.156 176.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -38.58 74.25 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.915 0.864 . . . . 0.0 111.588 173.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -51.26 -57.29 9.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 128.229 2.611 . . . . 0.0 107.761 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.8 t -53.69 -33.45 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 119.124 0.875 . . . . 0.0 112.184 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -67.81 -42.68 81.19 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.543 0.61 . . . . 0.0 111.164 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.2 t -82.13 -31.59 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 125.527 1.531 . . . . 0.0 112.229 -175.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -89.15 -40.85 12.62 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.457 1.903 . . . . 0.0 108.733 -173.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.49 10.39 83.5 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 118.997 -0.891 . . . . 0.0 111.092 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.9 pt -141.85 144.61 25.31 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 118.153 0.977 . . . . 0.0 110.149 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.12 159.75 25.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 124.852 1.261 . . . . 0.0 113.73 -175.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -53.08 -42.14 65.6 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 113.045 -1.888 . . . . 0.0 109.267 169.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.74 -54.79 28.81 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -65.71 -36.4 83.51 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 117.243 0.522 . . . . 0.0 110.957 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -63.1 -47.72 81.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.801 0.441 . . . . 0.0 110.226 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.46 -19.6 66.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 177.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.39 -36.72 24.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.681 0.793 . . . . 0.0 111.039 175.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.16 148.43 84.8 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.594 0.757 . . . . 0.0 109.621 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -52.92 145.94 38.71 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.207 2.604 . . . . 0.0 112.88 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.81 -33.66 35.68 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.301 0.953 . . . . 0.0 112.781 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -68.44 -49.73 57.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.762 0.781 . . . . 0.0 110.982 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -61.01 -36.92 80.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -59.52 -58.0 10.49 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 122.98 0.512 . . . . 0.0 110.119 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -38.2 88.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.911 0.484 . . . . 0.0 110.501 -175.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -58.43 -52.79 64.16 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 119.177 -0.439 . . . . 0.0 110.32 176.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.3 mtp -54.59 -41.06 69.47 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.293 -0.86 . . . . 0.0 112.706 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -55.55 -53.59 54.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.296 0.953 . . . . 0.0 110.669 176.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -58.82 -47.81 83.51 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.268 0.627 . . . . 0.0 111.591 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.8 -52.68 55.55 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.25 1.42 . . . . 0.0 111.129 -172.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -58.94 -28.14 65.98 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.236 0.614 . . . . 0.0 110.582 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.95 -90.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 168.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -170.55 27.76 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.538 1.135 . . . . 0.0 111.742 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 116.546 -1.692 . . . . 0.0 108.251 -173.356 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.022 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -173.81 1.97 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.71 0.804 . . . . 0.0 111.911 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.4 mp 55.08 78.22 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.908 1.283 . . . . 0.0 111.222 -175.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 67.6 m -57.45 138.03 55.52 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 169.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -58.19 -22.97 53.84 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -169.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -79.16 -48.49 14.16 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.01 0.924 . . . . 0.0 111.758 174.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.2 -38.84 77.53 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.884 0.874 . . . . 0.0 109.878 174.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -55.38 -58.08 9.19 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.964 2.106 . . . . 0.0 107.845 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -53.17 -36.13 24.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 120.4 1.455 . . . . 0.0 111.693 177.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.2 t -65.02 -39.38 93.3 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.558 0.617 . . . . 0.0 111.646 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.7 t -84.83 -32.82 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.539 1.536 . . . . 0.0 111.81 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -93.35 -49.52 5.9 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.404 1.881 . . . . 0.0 109.75 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.29 9.56 84.84 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.304 -1.275 . . . . 0.0 111.228 -170.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 pt -117.63 140.96 38.6 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 CA-C-N 118.814 1.307 . . . . 0.0 110.286 175.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.97 158.3 34.98 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.769 1.228 . . . . 0.0 113.649 -175.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -52.88 -39.96 63.09 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.496 2.318 . . . . 0.0 110.307 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.51 -52.85 48.43 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -65.02 -43.13 93.44 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 117.653 0.727 . . . . 0.0 110.737 -177.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.07 -48.32 73.66 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.021 0.529 . . . . 0.0 111.324 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.54 65.5 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.22 -34.19 23.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.798 0.839 . . . . 0.0 111.102 174.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 mt -61.61 144.59 92.57 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -53.42 145.22 46.97 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.813 2.342 . . . . 0.0 112.487 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.02 -33.49 36.93 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.989 0.804 . . . . 0.0 112.824 178.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.39 -49.44 63.85 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 117.562 0.681 . . . . 0.0 110.921 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.75 -37.98 83.64 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -59.35 -55.91 28.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.12 0.568 . . . . 0.0 110.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.08 -37.14 86.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.095 0.558 . . . . 0.0 110.391 -176.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -62.72 -51.94 65.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.415 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.4 mtp -54.72 -45.45 74.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.711 0.687 . . . . 0.0 112.735 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -51.04 -55.28 18.28 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.05 0.54 . . . . 0.0 110.242 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -66.09 -36.67 83.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.782 0.833 . . . . 0.0 112.68 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -66.77 -45.43 78.55 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.475 1.11 . . . . 0.0 110.842 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -58.91 -28.01 65.8 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.804 0.275 . . . . 0.0 110.876 171.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -68.64 -92.31 0.06 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -166.37 28.98 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 112.045 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.88 -177.816 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.013 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -88.1 -117.56 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.92 0.888 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 tp -161.15 117.53 2.22 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 103.454 -2.795 . . . . 0.0 103.454 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.9 m -53.24 139.64 28.8 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.411 1.084 . . . . 0.0 111.032 -169.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -30.31 19.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.874 1.269 . . . . 0.0 113.451 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 -84.0 -45.14 13.44 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 175.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.01 -37.29 66.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.986 0.914 . . . . 0.0 110.457 173.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.27 -58.4 7.21 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 127.338 2.255 . . . . 0.0 107.287 170.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.72 -32.89 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 119.284 0.947 . . . . 0.0 111.133 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -65.64 -48.1 73.34 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.056 0.389 . . . . 0.0 110.632 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.5 t -75.0 -32.71 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.155 1.382 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -83.06 -38.02 23.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.971 1.709 . . . . 0.0 108.409 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.66 17.04 69.13 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 pt -150.8 142.11 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.35 160.91 23.64 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -176.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -52.9 -39.7 62.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 113.624 -1.625 . . . . 0.0 109.86 169.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.26 -55.52 23.18 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -58.51 -45.22 89.2 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.745 0.418 . . . . 0.0 110.967 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -60.43 -48.16 82.98 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.779 0.832 . . . . 0.0 110.245 -178.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.86 -19.52 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.81 -34.76 22.66 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.728 0.811 . . . . 0.0 111.194 175.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.68 150.78 80.71 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.566 0.746 . . . . 0.0 109.812 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -53.31 145.82 43.18 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.082 2.521 . . . . 0.0 112.876 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.43 -33.44 32.46 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.373 0.987 . . . . 0.0 112.751 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.99 -51.02 52.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.645 0.723 . . . . 0.0 110.999 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -61.95 -34.07 75.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -61.46 -57.55 11.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.302 0.641 . . . . 0.0 110.36 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -39.46 94.17 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 122.651 0.38 . . . . 0.0 110.335 -176.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -59.25 -52.04 67.39 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.086 0.554 . . . . 0.0 110.341 176.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 51.7 mmm -54.99 -44.23 74.3 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.352 0.661 . . . . 0.0 112.208 178.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -56.32 -51.03 69.74 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.395 0.543 . . . . 0.0 110.885 177.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.92 -44.51 94.26 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.015 0.526 . . . . 0.0 111.924 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -67.32 -52.79 36.1 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.538 1.135 . . . . 0.0 111.002 -171.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.69 -29.73 64.91 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.605 0.762 . . . . 0.0 110.509 172.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.3 -90.05 0.02 OUTLIER Glycine 0 CA--C 1.533 1.2 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -160.16 29.28 0.17 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.853 0.861 . . . . 0.0 112.267 -176.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 36.5 t80 . . . . . 0 C--O 1.252 1.198 0 C-N-CA 124.662 1.185 . . . . 0.0 110.501 -178.75 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.007 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -154.78 -160.46 1.07 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.064 0.945 . . . . 0.0 108.846 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -163.96 127.91 2.69 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.6 1.56 . . . . 0.0 107.934 -171.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.1 m -51.22 144.67 9.1 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 125.584 1.554 . . . . 0.0 110.33 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -57.36 -20.31 28.45 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -172.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -79.9 -48.02 14.13 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.39 0.676 . . . . 0.0 111.172 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.37 80.73 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 111.714 173.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -53.37 -53.65 48.1 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 129.135 2.974 . . . . 0.0 107.837 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 t -54.2 -31.97 22.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.162 0.892 . . . . 0.0 111.955 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.1 t -67.45 -43.9 79.97 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.321 0.51 . . . . 0.0 110.969 176.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.48 -32.95 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.85 1.66 . . . . 0.0 112.389 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -88.48 -41.26 12.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.768 2.027 . . . . 0.0 108.888 -172.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.55 11.5 81.78 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 119.085 -0.842 . . . . 0.0 111.104 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.6 pt -142.64 142.55 26.59 Favored 'Isoleucine or valine' 0 C--N 1.343 0.308 0 CA-C-N 117.945 0.873 . . . . 0.0 109.78 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.38 158.93 22.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.321 1.049 . . . . 0.0 113.58 -175.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -54.33 -41.68 69.33 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 126.201 1.8 . . . . 0.0 110.164 169.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.14 -53.74 31.57 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 177.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -63.29 -39.57 94.95 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 117.264 0.532 . . . . 0.0 110.967 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -63.02 -48.18 79.9 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.334 0.654 . . . . 0.0 109.837 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.17 -19.53 66.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.44 0.534 . . . . 0.0 112.44 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.53 -35.7 22.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.787 0.835 . . . . 0.0 111.228 175.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.2 mt -61.07 150.37 78.92 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.618 0.767 . . . . 0.0 109.774 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.03 145.44 41.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.221 2.614 . . . . 0.0 112.803 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.52 -33.3 32.9 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.275 0.94 . . . . 0.0 112.804 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -67.64 -51.19 52.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.716 0.758 . . . . 0.0 110.97 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -62.01 -34.03 75.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -61.5 -58.6 7.5 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.024 0.529 . . . . 0.0 110.05 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -38.69 90.19 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.985 0.514 . . . . 0.0 110.465 -175.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -51.07 71.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.88 0.472 . . . . 0.0 110.202 175.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mmm -57.13 -39.15 74.59 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.927 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -57.62 -53.58 56.61 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.18 0.9 . . . . 0.0 110.505 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -56.95 -46.06 82.36 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.586 0.754 . . . . 0.0 111.692 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -68.41 -50.99 48.89 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.516 1.126 . . . . 0.0 110.905 -171.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -28.91 68.24 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.936 0.494 . . . . 0.0 110.275 173.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.09 -89.88 0.02 OUTLIER Glycine 0 CA--C 1.531 1.052 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 168.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -160.63 29.12 0.16 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.739 0.816 . . . . 0.0 112.158 -176.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 22.5 t80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.646 -177.642 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.009 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -146.46 23.72 1.28 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.742 1.217 . . . . 0.0 110.92 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -175.06 130.34 0.3 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.201 2.2 . . . . 0.0 106.734 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.7 p -50.66 141.4 12.81 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.802 0.841 . . . . 0.0 110.207 -176.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -55.22 -19.57 8.48 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.054 1.342 . . . . 0.0 113.668 -169.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -81.85 -48.12 11.96 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.124 0.57 . . . . 0.0 111.501 172.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.26 72.01 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.249 1.019 . . . . 0.0 111.457 172.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.51 -58.86 4.79 Favored 'General case' 0 CA--C 1.505 -0.759 0 C-N-CA 127.557 2.343 . . . . 0.0 107.785 173.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.5 t -59.24 -32.12 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 118.761 0.71 . . . . 0.0 111.2 -177.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.8 t -66.47 -46.29 76.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.031 0.378 . . . . 0.0 110.558 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.5 t -77.29 -32.44 18.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.297 1.439 . . . . 0.0 111.981 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -84.81 -39.39 18.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.929 1.692 . . . . 0.0 108.449 -173.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.22 16.89 70.62 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.2 pt -148.9 142.83 18.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.7 158.35 24.87 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -52.77 -41.56 64.18 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.226 1.81 . . . . 0.0 110.021 169.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.67 -54.12 30.71 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.13 -36.33 83.93 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 117.451 0.625 . . . . 0.0 110.974 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -61.67 -47.36 85.7 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.156 0.583 . . . . 0.0 109.974 177.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.79 -19.12 65.77 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.23 -36.23 22.89 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.731 0.812 . . . . 0.0 111.083 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 mt -61.31 153.1 70.13 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 123.893 0.877 . . . . 0.0 109.797 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.19 150.8 87.14 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.616 2.211 . . . . 0.0 111.195 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.42 -34.12 25.96 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.915 1.245 . . . . 0.0 112.808 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -68.53 -51.16 45.99 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.712 0.756 . . . . 0.0 110.751 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -62.31 -32.49 73.25 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -61.5 -57.22 13.01 Favored 'General case' 0 C--N 1.342 0.248 0 C-N-CA 123.308 0.643 . . . . 0.0 110.664 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.17 -38.56 91.51 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 122.701 0.401 . . . . 0.0 110.663 -176.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -51.86 67.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.865 1.266 . . . . 0.0 109.958 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.9 mmm -59.32 -46.81 87.56 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.338 0.655 . . . . 0.0 111.627 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -54.58 -49.62 69.94 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.5 0.591 . . . . 0.0 111.349 177.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.3 mtmt -60.96 -47.37 86.76 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.849 0.295 . . . . 0.0 111.462 176.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -64.24 -54.86 26.77 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.589 0.755 . . . . 0.0 111.473 -172.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -58.1 -29.24 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 110.444 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.44 -89.62 0.02 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.893 1.235 . . . . 0.0 110.201 169.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -158.42 28.1 0.24 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.805 0.842 . . . . 0.0 112.627 -173.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.036 178.912 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.032 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -67.58 110.79 3.83 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.254 0.622 . . . . 0.0 109.601 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.9 mp 54.64 82.11 0.1 Allowed 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.545 1.538 . . . . 0.0 112.5 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.6 m -62.22 137.73 58.3 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 168.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.87 -24.89 39.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.623 0.769 . . . . 0.0 112.619 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -81.35 -48.23 12.23 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.816 0.847 . . . . 0.0 111.848 175.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.28 -39.03 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.87 0.868 . . . . 0.0 111.597 174.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -49.82 -56.02 11.99 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 127.298 2.239 . . . . 0.0 107.75 171.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.07 -30.73 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 119.197 0.908 . . . . 0.0 111.214 -177.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.81 -48.64 68.33 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.429 0.559 . . . . 0.0 110.232 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.1 t -73.42 -32.15 35.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 125.302 1.441 . . . . 0.0 112.023 -177.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -86.44 -23.25 26.11 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.169 1.787 . . . . 0.0 109.61 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.35 28.18 19.17 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 124.694 1.14 . . . . 0.0 112.82 -172.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 19.9 pt -145.29 143.74 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 172.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.24 158.88 27.76 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.903 0.858 . . . . 0.0 113.274 -176.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -54.67 -40.45 69.09 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.944 1.697 . . . . 0.0 109.9 170.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.6 -54.39 29.2 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.141 0.877 . . . . 0.0 110.92 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -64.35 -38.18 90.13 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 117.353 0.577 . . . . 0.0 110.859 -178.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.11 -49.66 77.02 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.611 0.764 . . . . 0.0 109.941 176.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.2 65.75 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.73 -34.07 21.31 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.93 0.892 . . . . 0.0 111.414 175.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -61.63 154.04 67.69 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.679 0.792 . . . . 0.0 110.452 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.09 144.77 36.33 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.312 2.674 . . . . 0.0 112.619 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.66 -32.78 40.34 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.014 0.816 . . . . 0.0 112.595 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -68.1 -51.47 46.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.718 0.759 . . . . 0.0 110.808 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -61.58 -32.99 73.12 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -61.78 -58.73 6.87 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.127 0.571 . . . . 0.0 110.508 176.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -37.49 86.01 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 122.721 0.408 . . . . 0.0 111.072 -176.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -54.43 47.09 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.957 1.303 . . . . 0.0 109.984 175.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.3 mmm -56.78 -43.39 80.82 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 119.159 -0.448 . . . . 0.0 111.559 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -59.7 -48.36 81.98 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 118.929 -0.558 . . . . 0.0 111.865 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.52 70.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.844 0.747 . . . . 0.0 111.722 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.94 -63.24 1.17 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 109.682 -177.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -56.39 -30.02 62.22 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.083 0.553 . . . . 0.0 110.463 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -54.04 -87.62 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.741 1.638 . . . . 0.0 111.788 169.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.86 39.45 3.65 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.656 1.182 . . . . 0.0 113.424 -168.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 47.4 t80 . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.882 -1.056 . . . . 0.0 109.665 173.343 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.94 162.57 21.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.51 0.724 . . . . 0.0 111.532 . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.2 mp 54.2 83.8 0.07 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.76 1.224 . . . . 0.0 112.641 174.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.1 m -63.6 133.65 54.1 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 169.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -55.53 -23.67 27.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.77 0.828 . . . . 0.0 113.118 -169.756 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -78.64 -47.45 17.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.76 0.824 . . . . 0.0 111.561 175.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.59 -41.09 89.47 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.217 1.008 . . . . 0.0 111.1 174.203 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.9 -52.25 61.13 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.328 3.051 . . . . 0.0 108.293 174.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -52.97 -30.99 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 119.884 1.22 . . . . 0.0 112.045 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.1 t -68.85 -46.65 67.94 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.825 0.739 . . . . 0.0 110.865 176.668 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 85.8 t -78.08 -28.61 15.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.762 1.625 . . . . 0.0 112.468 -174.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -94.31 -30.03 14.74 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 126.908 2.083 . . . . 0.0 110.146 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 50.52 26.87 10.72 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.98 0.8 . . . . 0.0 112.927 -169.704 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.12 141.31 41.93 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 CA-C-N 117.84 0.82 . . . . 0.0 109.372 169.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.39 161.32 29.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 125.007 1.323 . . . . 0.0 113.408 -176.769 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -54.22 -41.21 68.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.875 1.67 . . . . 0.0 109.762 169.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.75 -54.33 26.02 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 110.714 -0.955 . . . . 0.0 110.714 -179.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -63.44 -38.84 92.71 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.833 0.453 . . . . 0.0 111.058 -179.169 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.74 -47.73 82.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.29 0.636 . . . . 0.0 109.795 177.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.33 -19.54 66.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.74 -35.64 24.25 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.803 0.841 . . . . 0.0 110.977 175.436 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 mt -60.7 152.05 69.37 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.597 0.759 . . . . 0.0 109.682 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.78 144.22 44.64 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.977 2.451 . . . . 0.0 112.41 177.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -31.64 47.12 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 123.864 0.745 . . . . 0.0 112.509 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.0 p-90 -68.08 -50.98 51.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.668 0.734 . . . . 0.0 110.601 174.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 tptp -62.49 -31.78 72.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -176.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -62.2 -57.98 9.46 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.324 0.65 . . . . 0.0 110.58 176.155 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.58 84.53 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.886 0.475 . . . . 0.0 110.551 -176.216 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -53.08 62.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.696 1.198 . . . . 0.0 109.646 175.294 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.8 mmm -58.78 -45.34 90.06 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.945 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -53.34 -52.47 59.11 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.456 0.571 . . . . 0.0 111.134 174.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -60.39 -43.09 96.96 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.584 0.754 . . . . 0.0 111.611 178.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.64 -53.15 16.97 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.053 0.941 . . . . 0.0 110.868 -171.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -59.41 -28.55 67.02 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.552 0.341 . . . . 0.0 110.382 172.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.68 -90.37 0.02 OUTLIER Glycine 0 CA--C 1.53 1.021 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 168.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -163.19 24.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.335 0.654 . . . . 0.0 112.645 -176.478 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.8 t80 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 117.547 -1.216 . . . . 0.0 110.016 -176.762 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.032 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -81.53 38.83 0.51 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.969 1.307 . . . . 0.0 111.576 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -173.95 130.87 0.4 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.095 2.158 . . . . 0.0 106.551 -176.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.2 m -43.12 137.04 2.65 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.066 1.346 . . . . 0.0 110.3 -175.811 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -57.51 -20.68 33.07 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -169.279 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -84.83 -46.01 11.76 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.677 0.672 . . . . 0.0 112.532 171.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.85 -37.26 63.46 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.375 1.07 . . . . 0.0 110.712 172.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -52.43 -58.7 5.89 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 127.216 2.207 . . . . 0.0 107.881 170.299 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -59.16 -31.99 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 118.778 0.717 . . . . 0.0 110.939 -176.81 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -65.28 -49.03 71.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.023 0.374 . . . . 0.0 110.455 177.439 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.3 t -75.16 -33.48 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.449 1.1 . . . . 0.0 111.868 -177.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -80.86 -34.71 33.54 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.054 1.742 . . . . 0.0 108.819 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.49 16.0 74.71 Favored Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 177.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.7 pt -151.31 144.9 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 -175.425 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.28 158.32 29.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.0 0.905 . . . . 0.0 113.235 -177.591 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.8 ttt180 -53.83 -39.6 65.7 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.281 1.832 . . . . 0.0 110.086 170.42 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.93 -54.84 27.99 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.07 0.843 . . . . 0.0 111.042 177.176 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.01 -36.56 84.77 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 117.437 0.619 . . . . 0.0 110.954 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -59.76 -48.86 79.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.817 0.847 . . . . 0.0 109.994 175.056 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.15 -19.38 65.95 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 178.459 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.64 -34.95 22.97 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.836 0.854 . . . . 0.0 111.353 175.193 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.04 152.89 58.81 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.57 0.748 . . . . 0.0 110.275 179.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.13 144.49 37.7 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.24 2.627 . . . . 0.0 112.514 177.552 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.17 -32.13 42.77 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 123.988 0.804 . . . . 0.0 112.496 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -68.29 -50.69 51.93 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.685 0.743 . . . . 0.0 110.734 175.157 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -61.94 -32.96 73.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.782 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -61.11 -57.69 11.47 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.883 0.473 . . . . 0.0 110.599 176.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -38.58 91.69 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.519 0.328 . . . . 0.0 110.684 -177.149 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -52.33 63.87 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.303 1.441 . . . . 0.0 109.691 175.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.2 mmm -58.7 -49.09 78.86 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.511 0.596 . . . . 0.0 111.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -57.4 -47.24 82.24 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.569 0.348 . . . . 0.0 111.268 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtmt -62.35 -44.71 95.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.852 0.461 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.43 -42.7 96.61 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.734 1.213 . . . . 0.0 111.588 -172.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -57.26 -30.68 64.87 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.457 0.303 . . . . 0.0 111.023 174.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.55 -91.59 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 169.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.52 35.02 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.719 1.208 . . . . 0.0 110.543 -175.199 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.7 t80 . . . . . 0 C--O 1.251 1.161 0 C-N-CA 125.832 1.653 . . . . 0.0 110.013 -169.536 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.023 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -73.54 94.72 2.17 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.438 0.695 . . . . 0.0 109.739 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.61 108.07 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.34 1.856 . . . . 0.0 113.573 169.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.0 p -67.28 142.38 56.89 Favored 'General case' 0 C--N 1.342 0.241 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 169.071 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -56.95 -26.47 59.68 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.984 0.914 . . . . 0.0 111.987 -170.207 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -78.73 -48.05 15.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.53 0.732 . . . . 0.0 111.763 177.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.18 -39.39 86.34 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.476 0.58 . . . . 0.0 111.63 174.304 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -51.52 -61.41 2.26 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 127.171 2.188 . . . . 0.0 107.367 170.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -53.14 -38.86 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.048 0.84 . . . . 0.0 112.342 178.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.9 t -62.05 -39.78 93.53 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 117.918 0.326 . . . . 0.0 111.463 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -89.32 -30.46 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.479 1.512 . . . . 0.0 111.823 -175.132 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.77 -39.37 18.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.095 1.358 . . . . 0.0 108.815 -169.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.13 23.63 56.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.072 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -130.39 -165.6 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 172.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.03 159.17 25.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 124.939 1.296 . . . . 0.0 112.499 170.755 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -50.46 -41.17 52.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.162 2.185 . . . . 0.0 110.239 169.877 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.26 -53.83 30.63 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 179.149 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -59.81 -45.46 92.28 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.025 0.53 . . . . 0.0 110.758 178.792 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -61.41 -44.91 96.33 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.326 0.65 . . . . 0.0 110.139 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -18.44 65.33 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 178.638 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -33.83 15.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.059 0.944 . . . . 0.0 111.311 176.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -62.5 152.73 79.67 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.691 0.797 . . . . 0.0 110.668 -176.237 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -52.54 144.62 40.84 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.355 2.703 . . . . 0.0 112.544 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.34 -32.94 45.51 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.982 0.801 . . . . 0.0 112.638 178.042 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -68.67 -49.18 61.11 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.774 0.787 . . . . 0.0 110.718 175.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -61.92 -32.87 73.31 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -62.52 -58.06 8.92 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.198 0.599 . . . . 0.0 110.344 176.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 -35.79 81.79 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.798 0.439 . . . . 0.0 110.978 -177.085 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -56.27 -55.39 33.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.875 1.67 . . . . 0.0 110.096 175.336 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.6 mmm -56.24 -46.48 79.55 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.777 0.431 . . . . 0.0 110.915 177.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -56.7 -50.03 73.37 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 178.163 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -71.12 -30.97 67.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.65 0.659 . . . . 0.0 111.287 -177.108 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -72.96 -57.39 4.08 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.164 0.585 . . . . 0.0 110.898 -177.694 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -59.09 -31.22 68.71 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.02 0.528 . . . . 0.0 110.079 174.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.92 -88.54 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 125.218 1.389 . . . . 0.0 111.073 169.318 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.42 43.1 0.59 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.504 1.122 . . . . 0.0 111.144 -169.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.3 t80 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 127.671 2.389 . . . . 0.0 111.107 -177.916 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -82.93 35.9 0.49 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.912 1.285 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -176.15 130.71 0.23 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.391 2.276 . . . . 0.0 106.661 -177.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.9 p -47.67 149.45 1.23 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 123.883 0.873 . . . . 0.0 111.164 -176.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -57.05 -23.61 47.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.874 0.47 . . . . 0.0 112.08 -175.323 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -84.83 -46.76 11.04 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 173.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.09 -37.97 67.51 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.408 0.623 . . . . 0.0 110.085 174.498 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -49.93 -59.65 3.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 127.549 2.34 . . . . 0.0 107.958 169.927 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.2 t -58.76 -32.76 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 119.101 0.864 . . . . 0.0 110.881 -177.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.3 t -65.25 -45.43 84.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.016 0.371 . . . . 0.0 110.822 178.628 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.3 t -80.3 -33.37 14.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.376 1.07 . . . . 0.0 111.718 -176.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -79.83 -35.2 38.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.988 1.715 . . . . 0.0 108.634 -175.736 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.33 15.89 75.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 177.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.0 pt -150.28 144.01 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.165 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.95 158.43 30.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 122.102 0.953 . . . . 0.0 113.237 -176.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -52.54 -39.86 61.89 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 126.456 1.902 . . . . 0.0 110.217 169.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.03 -55.3 25.01 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.139 0.876 . . . . 0.0 111.05 177.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.14 -35.68 81.86 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 117.357 0.578 . . . . 0.0 111.042 -178.246 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -60.7 -48.38 82.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.648 0.779 . . . . 0.0 110.005 175.298 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.24 65.84 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.4 -35.13 23.33 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.834 0.854 . . . . 0.0 111.211 175.117 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.25 152.92 60.93 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 123.54 0.736 . . . . 0.0 110.339 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.61 144.51 41.9 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.225 2.617 . . . . 0.0 112.578 177.722 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.86 -32.68 41.6 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.057 0.837 . . . . 0.0 112.591 177.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -68.26 -50.39 54.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.634 0.717 . . . . 0.0 110.779 175.32 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -62.07 -33.0 73.6 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.17 -57.44 12.46 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.04 0.536 . . . . 0.0 110.71 176.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -39.4 94.22 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.545 0.338 . . . . 0.0 110.651 -177.219 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.35 55.08 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.217 1.407 . . . . 0.0 109.489 175.634 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 45.8 mmm -58.41 -47.48 83.79 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 111.58 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -55.61 -49.62 72.33 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.392 0.277 . . . . 0.0 111.404 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -64.06 -42.64 96.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 178.15 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -57.29 -42.26 81.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.002 1.321 . . . . 0.0 112.271 -173.358 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -59.24 -32.32 69.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.049 0.386 . . . . 0.0 110.775 175.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.41 -90.2 0.1 Allowed Glycine 0 CA--C 1.529 0.91 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 169.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -156.53 24.11 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.457 1.103 . . . . 0.0 111.335 -177.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.673 1.589 . . . . 0.0 110.885 -169.959 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.01 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 37.1 p90 -148.39 23.8 1.02 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.679 1.192 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -170.29 129.66 0.89 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.544 1.538 . . . . 0.0 108.368 -174.312 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 m -39.56 139.69 0.56 Allowed 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 126.604 1.962 . . . . 0.0 111.629 178.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -43.03 -36.04 1.46 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.178 1.391 . . . . 0.0 113.331 -178.454 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -79.46 -44.36 21.47 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.176 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -58.84 -34.46 71.58 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.038 0.935 . . . . 0.0 110.464 173.679 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -57.92 -58.93 6.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.637 1.975 . . . . 0.0 107.205 171.53 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.99 -38.13 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 119.46 1.027 . . . . 0.0 111.965 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.2 t -61.37 -45.62 93.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.909 0.322 . . . . 0.0 111.197 178.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.79 -34.11 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.934 1.294 . . . . 0.0 111.984 -175.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -85.14 -36.25 21.2 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.524 1.53 . . . . 0.0 109.01 -170.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.83 7.4 88.04 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 178.494 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.0 pt -139.21 146.99 24.95 Favored 'Isoleucine or valine' 0 C--N 1.341 0.233 0 CA-C-N 117.786 0.793 . . . . 0.0 110.162 -177.725 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -62.54 156.91 21.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 122.174 0.988 . . . . 0.0 113.02 -177.286 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.8 ttp180 -57.39 -39.05 75.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.22 -1.809 . . . . 0.0 108.805 172.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.44 -53.18 33.8 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.352 0.977 . . . . 0.0 111.105 177.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -64.91 -36.66 85.1 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 117.815 0.807 . . . . 0.0 110.779 -178.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -60.91 -48.33 82.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.788 0.435 . . . . 0.0 110.608 176.092 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.38 65.85 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 178.026 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.62 -35.79 22.46 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.801 0.84 . . . . 0.0 111.142 175.069 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.24 150.45 79.48 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.568 0.747 . . . . 0.0 109.858 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.14 144.46 37.88 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.164 2.576 . . . . 0.0 112.493 176.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.69 -32.0 46.38 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.912 0.768 . . . . 0.0 112.608 178.122 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -67.57 -50.61 57.59 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.78 0.79 . . . . 0.0 110.612 174.463 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.04 -32.25 72.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.656 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.75 -57.54 11.51 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 122.83 0.452 . . . . 0.0 110.481 176.487 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -37.18 86.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.705 0.402 . . . . 0.0 110.873 -176.524 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -53.53 55.94 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.315 1.446 . . . . 0.0 109.451 173.979 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.9 mmm -57.66 -42.63 83.93 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.525 0.602 . . . . 0.0 111.334 178.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -57.57 -52.03 67.08 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.708 177.488 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.36 -35.32 77.56 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.313 0.506 . . . . 0.0 111.514 -176.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -71.5 -59.1 2.94 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -175.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -58.08 -33.26 68.88 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 122.814 0.446 . . . . 0.0 110.625 176.304 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -50.84 -88.12 0.01 OUTLIER Glycine 0 CA--C 1.529 0.923 0 C-N-CA 126.23 1.871 . . . . 0.0 111.3 169.038 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.44 40.64 0.21 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.192 0.597 . . . . 0.0 111.724 -169.774 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.618 -1.182 . . . . 0.0 110.5 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.69 -37.32 75.79 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.304 1.042 . . . . 0.0 110.285 175.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -54.38 -60.87 2.76 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 127.51 2.324 . . . . 0.0 107.427 171.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.4 t -51.62 -38.92 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.33 0.968 . . . . 0.0 112.513 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -62.68 -41.72 99.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.186 0.448 . . . . 0.0 111.524 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.2 t -84.53 -31.82 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.465 1.506 . . . . 0.0 112.124 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -87.23 -31.81 20.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.894 1.678 . . . . 0.0 109.717 -170.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.0 20.76 64.48 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -132.59 -168.07 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.48 157.02 23.5 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 124.948 1.299 . . . . 0.0 112.253 169.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -54.27 -38.97 66.44 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.009 172.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.58 -54.83 20.59 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -62.55 -37.6 86.76 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.075 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -62.5 -47.81 82.33 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.545 0.738 . . . . 0.0 110.131 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -19.22 65.78 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.24 -35.55 21.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.893 0.877 . . . . 0.0 111.191 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -60.6 151.71 69.82 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 123.513 0.725 . . . . 0.0 110.138 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.24 144.46 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.223 2.615 . . . . 0.0 112.524 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.92 -31.78 47.75 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.848 0.737 . . . . 0.0 112.565 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.9 p-90 -67.87 -49.95 59.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 117.747 0.773 . . . . 0.0 110.768 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.63 -34.37 75.55 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -60.2 -57.7 11.7 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 122.708 0.403 . . . . 0.0 110.527 177.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -36.69 84.86 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.878 0.471 . . . . 0.0 110.928 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -53.92 49.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 174.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 83.0 mtp -59.36 -46.01 89.82 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.876 0.762 . . . . 0.0 112.243 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -52.73 -53.13 52.09 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.037 0.38 . . . . 0.0 110.558 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -66.15 -37.76 86.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.759 0.824 . . . . 0.0 112.648 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 . . . . . 0 CA--C 1.527 0.089 0 C-N-CA 124.426 1.09 . . . . 0.0 111.534 -176.833 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.03 -32.67 71.12 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.436 0.694 . . . . 0.0 110.157 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -51.99 -56.64 13.0 Favored 'General case' 0 C--O 1.215 -0.717 0 C-N-CA 127.629 2.372 . . . . 0.0 108.13 171.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -54.97 -30.34 23.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 119.156 0.889 . . . . 0.0 111.687 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -68.25 -47.52 67.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.625 0.648 . . . . 0.0 110.898 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.2 t -77.28 -32.74 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.081 1.353 . . . . 0.0 112.138 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -87.53 -42.69 12.57 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.382 1.873 . . . . 0.0 108.614 -172.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.61 7.87 87.62 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.812 -0.994 . . . . 0.0 110.861 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.4 pt -137.1 142.33 37.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.302 1.051 . . . . 0.0 110.857 -176.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.26 162.56 28.24 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 126.346 1.859 . . . . 0.0 114.624 -175.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -44.89 54.66 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.536 2.334 . . . . 0.0 109.301 169.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.53 -54.81 31.27 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -67.98 -34.71 77.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.998 0.399 . . . . 0.0 111.527 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.96 -45.94 79.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -19.46 65.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.87 -36.99 24.94 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.591 0.756 . . . . 0.0 110.85 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.62 148.67 81.01 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 123.368 0.667 . . . . 0.0 109.888 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.34 146.38 32.46 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.356 2.704 . . . . 0.0 112.939 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -33.54 49.99 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.051 0.834 . . . . 0.0 112.682 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -65.05 -52.87 53.36 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 117.91 0.855 . . . . 0.0 110.06 173.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -62.46 -32.26 73.11 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 -174.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -61.93 -58.12 9.14 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 122.955 0.502 . . . . 0.0 110.962 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -36.39 81.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.86 0.464 . . . . 0.0 110.273 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.16 -51.62 60.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.853 1.661 . . . . 0.0 110.978 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mtp -49.96 -49.63 49.55 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.036 0.834 . . . . 0.0 111.475 175.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.8 mtpt -53.82 -48.09 70.25 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.142 0.428 . . . . 0.0 111.423 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.07 -44.76 95.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.819 0.448 . . . . 0.0 111.931 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 CA--C 1.529 0.155 0 C-N-CA 123.879 0.871 . . . . 0.0 110.734 -169.961 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.12 -36.42 72.89 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.463 0.705 . . . . 0.0 110.169 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.873 ' CZ ' ' CD2' ' A' ' 11' ' ' PHE . 3.3 t80 -51.43 -57.79 8.02 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 127.642 2.377 . . . . 0.0 107.455 172.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 t -59.27 -31.59 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-N 119.1 0.864 . . . . 0.0 111.217 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.88 -48.56 68.4 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.141 0.428 . . . . 0.0 110.52 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.8 -32.96 36.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.331 1.452 . . . . 0.0 112.072 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.873 ' CD2' ' CZ ' ' A' ' 7' ' ' PHE . 7.1 m-85 -83.65 -38.74 21.13 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 125.935 1.694 . . . . 0.0 108.296 -174.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.25 17.72 68.55 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.4 pt -150.06 143.37 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.93 158.97 26.68 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.3 ttt180 -52.54 -41.88 63.9 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.793 2.037 . . . . 0.0 110.094 169.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.31 29.09 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -65.16 -36.49 84.4 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.292 0.546 . . . . 0.0 111.085 -177.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -62.15 -48.5 79.81 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.058 0.543 . . . . 0.0 109.691 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.27 65.84 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.52 -35.57 22.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.895 0.878 . . . . 0.0 111.297 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.26 151.96 74.24 Favored Pre-proline 0 CA--C 1.536 0.419 0 C-N-CA 123.549 0.74 . . . . 0.0 110.202 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.47 146.11 43.55 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.202 2.601 . . . . 0.0 112.864 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.29 -33.93 32.26 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.439 1.018 . . . . 0.0 112.749 177.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.68 -51.44 49.59 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 117.766 0.783 . . . . 0.0 110.979 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -61.91 -33.82 74.94 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -61.92 -57.61 11.08 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.239 0.616 . . . . 0.0 110.343 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -39.26 93.48 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.7 0.4 . . . . 0.0 110.411 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -59.17 -52.9 63.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.007 0.523 . . . . 0.0 110.179 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 53.7 mmm -55.25 -44.08 75.2 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.371 0.668 . . . . 0.0 112.313 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -56.07 -51.67 67.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.374 0.533 . . . . 0.0 111.087 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -60.3 -45.35 93.66 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.858 0.463 . . . . 0.0 111.628 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 . . . . . 0 N--CA 1.456 -0.158 0 C-N-CA 124.347 1.059 . . . . 0.0 110.843 -173.061 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.76 -39.91 62.65 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.555 1.142 . . . . 0.0 111.758 172.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -52.35 -58.23 7.34 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 128.068 2.547 . . . . 0.0 107.884 174.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.28 -32.14 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 118.674 0.67 . . . . 0.0 110.998 -176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -66.28 -45.02 81.9 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.102 0.41 . . . . 0.0 110.673 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.7 t -77.79 -33.45 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.235 1.414 . . . . 0.0 111.99 -177.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -84.42 -38.57 20.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.784 1.633 . . . . 0.0 108.647 -173.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.39 16.95 70.05 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.9 pt -149.58 142.61 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.13 158.78 25.0 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -53.54 -41.01 65.98 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 126.19 1.796 . . . . 0.0 110.07 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.07 -53.62 29.0 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.84 -38.33 90.35 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.116 0.458 . . . . 0.0 111.012 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -62.31 -47.22 85.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.405 0.682 . . . . 0.0 109.875 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -19.33 65.87 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.59 -35.75 22.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.756 0.822 . . . . 0.0 111.153 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.94 153.04 67.68 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 123.852 0.861 . . . . 0.0 109.967 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.55 150.31 86.75 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.627 2.218 . . . . 0.0 111.252 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.37 -34.54 26.42 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.938 1.256 . . . . 0.0 112.853 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.7 p-90 -69.03 -49.66 55.63 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.747 0.773 . . . . 0.0 111.115 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -61.62 -35.4 77.77 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -60.68 -58.16 9.64 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 122.819 0.448 . . . . 0.0 110.202 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -39.39 92.97 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.793 0.437 . . . . 0.0 110.592 -176.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -56.34 -53.84 52.56 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.947 0.499 . . . . 0.0 109.836 175.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.7 mmm -56.84 -41.45 77.9 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.713 0.805 . . . . 0.0 112.246 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.26 -53.18 60.29 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.866 0.757 . . . . 0.0 110.838 175.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -59.76 -45.06 93.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.193 0.597 . . . . 0.0 111.49 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 . . . . . 0 CA--C 1.529 0.159 0 C-N-CA 124.601 1.16 . . . . 0.0 110.617 -172.054 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 . . . . . 0 CA--C 1.538 0.503 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.8 -33.62 66.86 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.748 1.219 . . . . 0.0 110.921 174.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -54.76 -57.1 12.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 127.375 2.27 . . . . 0.0 107.77 172.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -60.05 -33.13 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 118.807 0.731 . . . . 0.0 110.737 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 t -63.44 -48.65 76.85 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.012 0.369 . . . . 0.0 110.438 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 75.4 t -75.77 -32.94 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.584 1.154 . . . . 0.0 111.87 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.93 -24.72 28.26 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.993 1.717 . . . . 0.0 109.713 -173.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.38 28.51 20.49 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.645 1.117 . . . . 0.0 112.777 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.5 pt -144.91 141.75 23.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -66.5 159.39 27.33 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -176.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -53.95 -42.05 68.44 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 126.491 1.916 . . . . 0.0 110.19 169.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.26 -52.9 32.53 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -62.66 -40.47 97.15 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 116.972 0.386 . . . . 0.0 110.925 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.82 -49.34 78.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.353 0.661 . . . . 0.0 109.588 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -18.93 65.32 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.05 -33.86 19.38 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.006 0.922 . . . . 0.0 111.426 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.03 154.36 69.34 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 123.801 0.841 . . . . 0.0 110.571 -177.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.22 145.75 33.85 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.291 2.661 . . . . 0.0 112.653 176.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.61 -33.82 42.11 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.063 0.839 . . . . 0.0 112.658 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -67.25 -51.39 53.69 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 117.724 0.762 . . . . 0.0 110.679 175.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.02 -32.83 73.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.4 -58.85 6.54 Favored 'General case' 0 C--N 1.34 0.168 0 O-C-N 121.952 -0.467 . . . . 0.0 110.545 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.15 -38.52 89.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.661 0.384 . . . . 0.0 110.608 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -57.62 -55.63 32.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.606 1.563 . . . . 0.0 110.5 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 73.8 mmm -56.88 -44.16 81.99 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.63 0.65 . . . . 0.0 111.913 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -56.41 -52.07 66.01 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.371 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.08 -43.37 92.38 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.045 0.384 . . . . 0.0 111.443 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 . . . . . 0 N--CA 1.453 -0.286 0 C-N-CA 123.245 0.618 . . . . 0.0 111.035 -169.392 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 111.377 0.14 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.58 -37.74 65.89 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.035 1.334 . . . . 0.0 110.988 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -52.33 -57.47 9.67 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 127.407 2.283 . . . . 0.0 108.131 172.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -61.12 -31.58 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 118.359 0.527 . . . . 0.0 110.705 -176.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.0 t -64.99 -44.85 87.95 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.963 0.347 . . . . 0.0 110.658 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.1 t -79.84 -34.95 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.475 1.11 . . . . 0.0 111.786 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -79.8 -32.72 40.79 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.823 1.649 . . . . 0.0 108.775 -175.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.79 15.31 75.74 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 pt -151.86 146.57 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -175.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.22 158.2 29.47 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -53.41 -39.86 64.66 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.102 -1.863 . . . . 0.0 109.87 170.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.4 -54.28 30.48 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.177 0.894 . . . . 0.0 111.08 177.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.89 -36.15 83.43 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 117.511 0.656 . . . . 0.0 110.972 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.48 -48.64 80.88 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.421 0.689 . . . . 0.0 110.146 175.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.81 -19.29 65.77 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.83 -34.99 22.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.855 0.862 . . . . 0.0 111.351 175.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.32 153.03 61.09 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.59 0.756 . . . . 0.0 110.373 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.72 144.76 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.227 2.618 . . . . 0.0 112.735 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.54 -32.84 39.59 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.088 0.851 . . . . 0.0 112.62 177.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -68.18 -50.59 53.34 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 117.766 0.783 . . . . 0.0 110.844 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.9 -35.07 75.71 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.16 -57.95 10.61 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.695 0.398 . . . . 0.0 110.576 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -37.22 86.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.896 0.478 . . . . 0.0 110.654 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -57.13 -54.58 45.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.113 1.365 . . . . 0.0 110.284 177.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.0 mtp -55.61 -45.52 77.5 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 118.16 0.436 . . . . 0.0 111.603 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.36 -49.14 78.28 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 119.274 -0.394 . . . . 0.0 111.625 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -70.62 -29.24 65.57 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.538 0.608 . . . . 0.0 111.974 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 . . . . . 0 C--N 1.34 0.179 0 C-N-CA 123.937 0.895 . . . . 0.0 110.646 177.773 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.38 -37.03 76.91 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.664 0.665 . . . . 0.0 111.487 176.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -47.69 -57.53 5.41 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 126.795 2.038 . . . . 0.0 107.929 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -60.3 -31.36 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 119.184 0.902 . . . . 0.0 111.101 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 t -67.25 -45.73 75.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.157 0.435 . . . . 0.0 110.547 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.2 t -75.87 -33.69 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.257 1.423 . . . . 0.0 111.755 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -82.74 -38.23 23.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.425 1.49 . . . . 0.0 108.583 -173.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.28 18.23 67.28 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.0 pt -150.4 143.28 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.37 159.52 26.7 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -175.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -53.6 -41.29 66.47 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.832 1.653 . . . . 0.0 110.15 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.49 -53.84 29.73 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.58 -39.39 93.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.025 0.412 . . . . 0.0 110.924 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -61.31 -48.93 79.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.647 0.779 . . . . 0.0 109.834 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.4 65.91 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.15 -34.78 22.04 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.874 0.869 . . . . 0.0 111.362 175.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -60.98 152.64 69.78 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.685 0.794 . . . . 0.0 110.283 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.36 144.69 39.03 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.272 2.648 . . . . 0.0 112.588 177.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.81 -32.74 41.33 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 123.989 0.804 . . . . 0.0 112.67 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.87 -50.83 54.2 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 117.68 0.74 . . . . 0.0 110.764 174.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.0 -32.62 73.11 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -177.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -61.44 -56.65 17.85 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 122.921 0.488 . . . . 0.0 110.571 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.43 -39.66 94.26 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.431 0.292 . . . . 0.0 110.615 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -51.4 64.36 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.254 1.422 . . . . 0.0 109.814 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 60.7 mmm -61.94 -44.0 97.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.65 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -54.86 -52.25 63.4 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.644 0.656 . . . . 0.0 111.121 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.77 -48.55 80.83 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 111.652 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 . . . . . 0 N--CA 1.455 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 111.023 -173.462 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.51 -33.69 73.0 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.457 1.103 . . . . 0.0 110.733 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -53.31 -52.96 57.44 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 128.98 2.912 . . . . 0.0 108.141 171.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 t -57.21 -32.92 41.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 119.382 0.992 . . . . 0.0 111.049 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.2 t -68.55 -24.11 64.59 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.6 t -105.22 -32.54 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.889 1.675 . . . . 0.0 111.425 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -86.06 -38.82 17.42 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.94 2.096 . . . . 0.0 108.738 -175.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.89 11.59 82.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.075 -0.847 . . . . 0.0 111.155 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.3 pt -142.46 142.12 27.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 118.013 0.907 . . . . 0.0 109.45 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.99 157.92 29.59 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.99 0.9 . . . . 0.0 113.083 -176.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -52.69 -40.11 62.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 126.587 1.955 . . . . 0.0 110.063 170.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.25 -55.16 27.63 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -66.28 -37.66 85.95 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 117.288 0.544 . . . . 0.0 110.701 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -60.38 -48.94 79.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.618 0.767 . . . . 0.0 109.923 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.03 -19.27 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.59 -34.69 21.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.891 0.876 . . . . 0.0 111.317 175.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.31 152.67 71.92 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.817 0.847 . . . . 0.0 110.249 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -51.79 144.98 32.96 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.322 2.682 . . . . 0.0 112.623 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.94 -33.28 43.43 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 123.944 0.783 . . . . 0.0 112.58 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.4 p-90 -68.59 -48.95 62.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.742 0.771 . . . . 0.0 110.752 175.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -62.03 -32.98 73.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.29 -57.67 10.53 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.062 0.545 . . . . 0.0 110.533 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.71 -38.83 92.58 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.57 0.348 . . . . 0.0 110.733 -177.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -51.67 -57.13 10.07 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.283 1.433 . . . . 0.0 109.43 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 69.2 mmm -59.31 -47.05 86.87 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 111.694 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -54.19 -50.18 67.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.466 0.575 . . . . 0.0 111.525 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -60.67 -54.46 45.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.527 0.331 . . . . 0.0 111.273 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 . . . . . 0 CA--C 1.529 0.148 0 C-N-CA 124.948 1.299 . . . . 0.0 112.107 -169.876 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -57.26 -34.75 68.95 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.717 0.807 . . . . 0.0 110.161 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -53.33 -58.52 6.82 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 127.908 2.483 . . . . 0.0 107.91 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.7 t -53.84 -32.47 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 118.733 0.697 . . . . 0.0 111.826 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -66.77 -45.53 78.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.495 0.589 . . . . 0.0 110.914 177.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -80.86 -32.8 12.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 125.464 1.506 . . . . 0.0 112.342 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -88.93 -38.09 14.76 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.881 2.073 . . . . 0.0 108.862 -173.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.2 8.52 86.33 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.907 -0.941 . . . . 0.0 111.258 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.5 pt -141.95 142.75 27.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.323 0 CA-C-N 118.153 0.977 . . . . 0.0 110.493 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.45 160.22 25.39 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 125.268 1.427 . . . . 0.0 113.933 -174.249 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -51.08 -44.08 61.14 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.801 2.041 . . . . 0.0 109.052 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -53.56 32.16 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -64.0 -37.65 88.21 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.902 0.351 . . . . 0.0 110.995 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -66.69 -45.9 77.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -19.5 65.98 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.18 -36.71 24.47 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.647 0.779 . . . . 0.0 111.01 174.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.28 148.8 84.61 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 123.356 0.662 . . . . 0.0 110.043 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.48 145.22 47.68 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.275 2.65 . . . . 0.0 112.96 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.68 -33.03 33.56 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.296 0.951 . . . . 0.0 112.961 177.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 13.3 p-90 -68.2 -49.89 57.83 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 117.811 0.806 . . . . 0.0 111.025 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.54 -37.51 81.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -59.6 -58.28 9.29 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.556 0.342 . . . . 0.0 110.182 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -38.11 86.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.779 0.432 . . . . 0.0 110.633 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -59.9 -51.58 69.11 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.075 0.55 . . . . 0.0 110.611 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.5 mtp -54.62 -42.09 70.78 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.305 176.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.57 -52.58 64.26 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.012 0.823 . . . . 0.0 111.226 178.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -68.53 -32.49 72.47 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 . . . . . 0 C--N 1.34 0.162 0 C-N-CA 123.885 0.874 . . . . 0.0 110.75 -177.109 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.59 -40.96 80.22 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.762 0.825 . . . . 0.0 111.13 173.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.648 ' HZ ' ' CD1' ' A' ' 18' ' ' PHE . 3.3 t80 -53.1 -58.01 8.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 126.982 2.113 . . . . 0.0 107.822 171.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.3 t -58.1 -34.65 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 119.574 1.079 . . . . 0.0 111.673 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.7 t -64.4 -42.27 96.19 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.511 0.596 . . . . 0.0 111.235 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t -80.94 -35.83 14.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 124.9 1.28 . . . . 0.0 111.431 -176.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.0 -45.14 13.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.188 1.395 . . . . 0.0 109.693 -172.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.5 15.18 76.77 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.816 -0.991 . . . . 0.0 111.03 -173.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.1 pt -110.46 -160.08 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.403 0 CA-C-N 118.301 1.051 . . . . 0.0 108.305 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.65 158.13 30.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.217 1.407 . . . . 0.0 112.853 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -55.14 -39.09 69.06 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 113.12 -1.854 . . . . 0.0 110.56 170.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.99 -55.35 28.67 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.9 -42.46 99.79 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 117.053 0.427 . . . . 0.0 110.705 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.648 ' CD1' ' HZ ' ' A' ' 7' ' ' PHE . 46.8 t80 -57.02 -45.62 82.95 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.042 0.937 . . . . 0.0 111.043 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.43 -19.08 65.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.07 -28.27 22.65 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.927 0.891 . . . . 0.0 111.431 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.06 144.93 90.33 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 177.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -54.07 143.81 60.67 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.298 1.998 . . . . 0.0 111.662 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.19 -32.13 50.28 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 123.384 0.516 . . . . 0.0 112.559 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -65.93 -50.5 64.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.644 0.722 . . . . 0.0 110.676 174.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -60.88 -35.11 75.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -62.07 -54.53 40.14 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.869 0.468 . . . . 0.0 110.546 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.21 -40.58 96.36 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.044 0.538 . . . . 0.0 110.67 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -53.64 56.07 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.777 1.231 . . . . 0.0 110.544 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.1 mmm -59.28 -43.59 92.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.027 0.531 . . . . 0.0 111.233 -177.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -57.36 -49.9 74.7 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.21 -0.424 . . . . 0.0 111.21 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -70.95 -28.9 64.81 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.424 0.557 . . . . 0.0 112.414 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 . . . . . 0 C--N 1.341 0.2 0 C-N-CA 123.64 0.776 . . . . 0.0 110.167 175.974 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 . . . . . 0 CA--C 1.541 0.597 0 CA-C-O 120.325 0.107 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.5 -32.91 69.25 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.979 1.312 . . . . 0.0 111.197 173.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.0 -53.62 56.39 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 128.461 2.704 . . . . 0.0 108.204 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.5 t -53.68 -33.94 23.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.802 0.728 . . . . 0.0 111.476 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.4 t -65.94 -32.22 73.59 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.3 t -97.21 -32.68 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.646 1.578 . . . . 0.0 111.511 -174.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -87.17 -41.0 14.09 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.06 1.744 . . . . 0.0 109.179 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.31 85.02 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 119.026 -0.874 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.41 144.13 29.58 Favored 'Isoleucine or valine' 0 C--N 1.344 0.357 0 CA-C-N 118.094 0.947 . . . . 0.0 110.053 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.07 158.97 27.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.31 1.052 . . . . 0.0 113.485 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -52.19 -40.76 61.95 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.211 2.205 . . . . 0.0 110.032 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.88 -54.37 31.28 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.217 0.913 . . . . 0.0 111.142 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -59.03 -46.02 89.26 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 117.229 0.514 . . . . 0.0 110.782 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -61.67 -46.69 88.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.052 0.541 . . . . 0.0 110.405 -176.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.06 -19.32 65.81 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 178.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.12 -34.87 20.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.893 0.877 . . . . 0.0 111.22 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.1 mt -61.36 150.4 80.26 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.763 0.825 . . . . 0.0 109.907 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.0 144.86 35.23 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.329 2.686 . . . . 0.0 112.622 177.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.19 -33.02 44.67 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.882 0.753 . . . . 0.0 112.71 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.77 -50.38 57.42 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.61 0.705 . . . . 0.0 110.673 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -62.15 -33.09 73.84 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.243 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.79 -57.82 11.05 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 122.98 0.512 . . . . 0.0 110.392 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -38.56 91.63 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.55 0.34 . . . . 0.0 110.848 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.52 -54.63 38.49 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.248 1.419 . . . . 0.0 109.908 174.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -59.53 -41.7 90.6 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 118.788 -0.625 . . . . 0.0 112.268 178.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -57.33 -50.72 72.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.953 0.797 . . . . 0.0 111.019 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.72 -44.25 93.82 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.863 0.465 . . . . 0.0 112.001 176.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 . . . . . 0 CA--C 1.528 0.126 0 C-N-CA 123.842 0.857 . . . . 0.0 111.539 -174.078 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.22 -38.42 83.31 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.542 0.61 . . . . 0.0 111.51 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -49.56 -59.75 3.48 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 126.675 1.99 . . . . 0.0 107.472 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -54.23 -37.78 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.284 0.947 . . . . 0.0 112.653 177.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.7 t -64.09 -41.43 97.29 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.238 0.472 . . . . 0.0 111.453 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.4 t -83.57 -31.54 8.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.82 1.648 . . . . 0.0 111.509 -176.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.74 -38.82 19.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.863 1.265 . . . . 0.0 108.907 -170.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.04 24.04 55.94 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.2 pp -133.71 -169.83 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.06 158.21 20.62 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.609 1.164 . . . . 0.0 112.569 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -51.58 -39.49 57.97 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.365 -1.743 . . . . 0.0 110.097 170.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.31 -54.39 27.13 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.08 -45.34 87.29 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.038 0.535 . . . . 0.0 110.74 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -59.3 -46.8 87.59 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.619 0.768 . . . . 0.0 110.435 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.52 -18.65 65.48 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.42 -33.96 16.64 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.907 . . . . 0.0 111.225 175.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.07 151.2 86.83 Favored Pre-proline 0 CA--C 1.536 0.434 0 C-N-CA 123.614 0.766 . . . . 0.0 110.034 -177.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.58 144.47 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.194 2.596 . . . . 0.0 112.564 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.41 -31.92 44.1 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.001 0.81 . . . . 0.0 112.628 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -68.28 -50.39 53.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.771 0.786 . . . . 0.0 110.635 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.96 -33.14 73.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -177.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -61.03 -57.52 12.25 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 123.023 0.529 . . . . 0.0 110.319 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.56 -37.65 88.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.79 0.436 . . . . 0.0 110.926 -176.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -53.98 47.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.243 1.417 . . . . 0.0 109.543 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 62.0 mtm -62.33 -40.05 95.09 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.197 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.53 -52.25 65.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.899 0.772 . . . . 0.0 111.062 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -58.17 -47.46 83.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 175.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.285 0.634 . . . . 0.0 111.105 -169.958 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 119.688 -0.196 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.23 -38.61 77.19 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.407 0.683 . . . . 0.0 109.611 175.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.416 ' CE2' ' CD2' ' A' ' 11' ' ' PHE . 9.0 t80 -57.62 -61.11 2.74 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.855 2.062 . . . . 0.0 107.479 173.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -50.55 -38.13 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 120.09 1.314 . . . . 0.0 112.138 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 t -60.82 -35.09 75.63 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.7 t -99.06 -33.06 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 125.949 1.699 . . . . 0.0 111.99 -173.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.416 ' CD2' ' CE2' ' A' ' 7' ' ' PHE . 12.8 m-85 -90.83 -39.05 12.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.559 1.943 . . . . 0.0 109.355 -169.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.44 6.15 89.43 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.545 -1.141 . . . . 0.0 111.399 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.6 pt -123.6 140.86 45.87 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.343 1.071 . . . . 0.0 110.348 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.3 159.06 30.04 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.72 1.208 . . . . 0.0 113.455 -175.247 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -53.79 -39.74 65.7 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 126.575 1.95 . . . . 0.0 110.451 169.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.09 -54.88 32.98 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.173 0.892 . . . . 0.0 110.9 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -65.3 -40.31 93.64 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 117.468 0.634 . . . . 0.0 110.82 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -57.21 -48.96 77.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.678 0.791 . . . . 0.0 110.798 174.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.81 -19.69 65.79 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.33 -35.61 25.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.618 0.767 . . . . 0.0 111.0 174.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.96 147.39 90.07 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.73 145.23 50.38 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.725 2.283 . . . . 0.0 112.66 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.88 -33.04 35.08 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.165 0.888 . . . . 0.0 112.725 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.71 -50.63 56.51 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 117.672 0.736 . . . . 0.0 110.975 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.9 tptp -62.22 -34.2 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -61.36 -58.3 8.77 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.503 0.721 . . . . 0.0 110.183 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -38.79 91.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.37 0.668 . . . . 0.0 110.62 -175.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -59.31 -55.0 40.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.803 0.441 . . . . 0.0 109.999 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.6 mmm -56.19 -42.9 77.87 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.79 0.836 . . . . 0.0 112.4 -177.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -54.27 -55.11 31.46 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.578 0.351 . . . . 0.0 110.896 174.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -63.92 -33.64 76.17 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.776 0.83 . . . . 0.0 112.925 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 N--CA 1.456 -0.132 0 C-N-CA 124.19 0.996 . . . . 0.0 111.274 -175.961 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 CA--C 1.538 0.493 0 N-CA-C 111.3 0.111 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -40.22 93.34 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.687 0.795 . . . . 0.0 109.714 175.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -50.58 -62.0 1.86 Allowed 'General case' 0 C--O 1.216 -0.684 0 C-N-CA 127.727 2.411 . . . . 0.0 107.397 170.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 t -50.95 -39.16 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.577 1.081 . . . . 0.0 112.201 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -65.03 -31.34 72.52 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -101.11 -27.72 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 125.818 1.647 . . . . 0.0 111.545 -173.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -85.2 -45.62 11.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.47 1.908 . . . . 0.0 108.393 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.75 13.32 80.05 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -175.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.07 141.86 37.22 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 118.132 0.966 . . . . 0.0 109.929 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.72 161.91 27.29 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.901 1.28 . . . . 0.0 113.358 -177.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -56.36 -41.75 76.66 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.564 1.946 . . . . 0.0 108.134 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.45 -53.43 28.7 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.24 -38.78 92.51 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.515 0.326 . . . . 0.0 110.943 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.55 -48.15 80.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.941 0.496 . . . . 0.0 109.673 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.84 -19.67 65.99 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.88 -35.71 23.93 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.851 0.86 . . . . 0.0 111.123 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -61.2 151.51 75.63 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.588 0.755 . . . . 0.0 109.902 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -53.53 145.77 45.72 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.124 2.55 . . . . 0.0 112.939 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.11 -33.64 30.42 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 124.465 1.031 . . . . 0.0 112.853 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -68.44 -50.65 51.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 117.658 0.729 . . . . 0.0 111.049 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.75 -34.63 76.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -61.33 -57.51 12.02 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.253 0.621 . . . . 0.0 110.395 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -39.81 95.55 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.059 -176.355 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.27 -54.67 44.11 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.975 0.51 . . . . 0.0 110.028 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.9 mmm -54.49 -44.41 72.65 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.275 0.63 . . . . 0.0 112.153 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -56.24 -50.47 71.2 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.115 0.416 . . . . 0.0 111.779 176.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -63.05 -45.0 94.31 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 118.169 0.441 . . . . 0.0 111.973 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 . . . . . 0 N--CA 1.453 -0.31 0 C-N-CA 123.7 0.8 . . . . 0.0 111.399 -169.246 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -38.58 74.25 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.915 0.864 . . . . 0.0 111.588 173.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -51.26 -57.29 9.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 128.229 2.611 . . . . 0.0 107.761 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.8 t -53.69 -33.45 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 119.124 0.875 . . . . 0.0 112.184 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -67.81 -42.68 81.19 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.543 0.61 . . . . 0.0 111.164 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.2 t -82.13 -31.59 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 125.527 1.531 . . . . 0.0 112.229 -175.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -89.15 -40.85 12.62 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.457 1.903 . . . . 0.0 108.733 -173.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.49 10.39 83.5 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 118.997 -0.891 . . . . 0.0 111.092 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.9 pt -141.85 144.61 25.31 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 118.153 0.977 . . . . 0.0 110.149 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.12 159.75 25.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 124.852 1.261 . . . . 0.0 113.73 -175.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -53.08 -42.14 65.6 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 113.045 -1.888 . . . . 0.0 109.267 169.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.74 -54.79 28.81 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -65.71 -36.4 83.51 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 117.243 0.522 . . . . 0.0 110.957 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -63.1 -47.72 81.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.801 0.441 . . . . 0.0 110.226 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.46 -19.6 66.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 177.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.39 -36.72 24.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.681 0.793 . . . . 0.0 111.039 175.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.16 148.43 84.8 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.594 0.757 . . . . 0.0 109.621 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -52.92 145.94 38.71 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.207 2.604 . . . . 0.0 112.88 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.81 -33.66 35.68 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.301 0.953 . . . . 0.0 112.781 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -68.44 -49.73 57.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.762 0.781 . . . . 0.0 110.982 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -61.01 -36.92 80.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -59.52 -58.0 10.49 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 122.98 0.512 . . . . 0.0 110.119 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -38.2 88.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.911 0.484 . . . . 0.0 110.501 -175.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -58.43 -52.79 64.16 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 119.177 -0.439 . . . . 0.0 110.32 176.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.3 mtp -54.59 -41.06 69.47 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.293 -0.86 . . . . 0.0 112.706 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -55.55 -53.59 54.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.296 0.953 . . . . 0.0 110.669 176.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -58.82 -47.81 83.51 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.268 0.627 . . . . 0.0 111.591 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 CA--C 1.528 0.114 0 C-N-CA 125.25 1.42 . . . . 0.0 111.129 -172.868 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 . . . . . 0 CA--C 1.537 0.455 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.2 -38.84 77.53 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.884 0.874 . . . . 0.0 109.878 174.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -55.38 -58.08 9.19 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.964 2.106 . . . . 0.0 107.845 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 13' ' ' ILE . 3.5 t -53.17 -36.13 24.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 120.4 1.455 . . . . 0.0 111.693 177.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.2 t -65.02 -39.38 93.3 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.558 0.617 . . . . 0.0 111.646 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.7 t -84.83 -32.82 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.539 1.536 . . . . 0.0 111.81 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -93.35 -49.52 5.9 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.404 1.881 . . . . 0.0 109.75 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.29 9.56 84.84 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.304 -1.275 . . . . 0.0 111.228 -170.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.401 ' O ' HG22 ' A' ' 8' ' ' VAL . 3.2 pt -117.63 140.96 38.6 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 CA-C-N 118.814 1.307 . . . . 0.0 110.286 175.385 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.97 158.3 34.98 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.769 1.228 . . . . 0.0 113.649 -175.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -52.88 -39.96 63.09 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.496 2.318 . . . . 0.0 110.307 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.51 -52.85 48.43 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -65.02 -43.13 93.44 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 117.653 0.727 . . . . 0.0 110.737 -177.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.07 -48.32 73.66 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.021 0.529 . . . . 0.0 111.324 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.54 65.5 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.22 -34.19 23.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.798 0.839 . . . . 0.0 111.102 174.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 mt -61.61 144.59 92.57 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -53.42 145.22 46.97 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.813 2.342 . . . . 0.0 112.487 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.02 -33.49 36.93 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.989 0.804 . . . . 0.0 112.824 178.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.39 -49.44 63.85 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 117.562 0.681 . . . . 0.0 110.921 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.75 -37.98 83.64 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -59.35 -55.91 28.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.12 0.568 . . . . 0.0 110.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.08 -37.14 86.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.095 0.558 . . . . 0.0 110.391 -176.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -62.72 -51.94 65.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.415 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.4 mtp -54.72 -45.45 74.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.711 0.687 . . . . 0.0 112.735 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -51.04 -55.28 18.28 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.05 0.54 . . . . 0.0 110.242 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -66.09 -36.67 83.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.782 0.833 . . . . 0.0 112.68 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--N 1.339 0.14 0 C-N-CA 124.475 1.11 . . . . 0.0 110.842 -176.753 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 . . . . . 0 CA--C 1.533 0.325 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.01 -37.29 66.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.986 0.914 . . . . 0.0 110.457 173.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.27 -58.4 7.21 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 127.338 2.255 . . . . 0.0 107.287 170.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.72 -32.89 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 119.284 0.947 . . . . 0.0 111.133 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -65.64 -48.1 73.34 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.056 0.389 . . . . 0.0 110.632 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.5 t -75.0 -32.71 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.155 1.382 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -83.06 -38.02 23.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.971 1.709 . . . . 0.0 108.409 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.66 17.04 69.13 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 pt -150.8 142.11 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.35 160.91 23.64 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -176.576 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -52.9 -39.7 62.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 113.624 -1.625 . . . . 0.0 109.86 169.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.26 -55.52 23.18 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -58.51 -45.22 89.2 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.745 0.418 . . . . 0.0 110.967 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -60.43 -48.16 82.98 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.779 0.832 . . . . 0.0 110.245 -178.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.86 -19.52 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.81 -34.76 22.66 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.728 0.811 . . . . 0.0 111.194 175.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.68 150.78 80.71 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.566 0.746 . . . . 0.0 109.812 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -53.31 145.82 43.18 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.082 2.521 . . . . 0.0 112.876 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.43 -33.44 32.46 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.373 0.987 . . . . 0.0 112.751 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.99 -51.02 52.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.645 0.723 . . . . 0.0 110.999 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -61.95 -34.07 75.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -61.46 -57.55 11.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.302 0.641 . . . . 0.0 110.36 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -39.46 94.17 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 122.651 0.38 . . . . 0.0 110.335 -176.07 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -59.25 -52.04 67.39 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.086 0.554 . . . . 0.0 110.341 176.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 51.7 mmm -54.99 -44.23 74.3 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.352 0.661 . . . . 0.0 112.208 178.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -56.32 -51.03 69.74 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.395 0.543 . . . . 0.0 110.885 177.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.92 -44.51 94.26 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.015 0.526 . . . . 0.0 111.924 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.457 -0.099 0 C-N-CA 124.538 1.135 . . . . 0.0 111.002 -171.585 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 120.363 0.125 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.37 80.73 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 111.714 173.177 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -53.37 -53.65 48.1 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 129.135 2.974 . . . . 0.0 107.837 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 t -54.2 -31.97 22.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.162 0.892 . . . . 0.0 111.955 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.1 t -67.45 -43.9 79.97 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.321 0.51 . . . . 0.0 110.969 176.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.48 -32.95 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.85 1.66 . . . . 0.0 112.389 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -88.48 -41.26 12.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.768 2.027 . . . . 0.0 108.888 -172.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.55 11.5 81.78 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 119.085 -0.842 . . . . 0.0 111.104 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.6 pt -142.64 142.55 26.59 Favored 'Isoleucine or valine' 0 C--N 1.343 0.308 0 CA-C-N 117.945 0.873 . . . . 0.0 109.78 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.38 158.93 22.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.321 1.049 . . . . 0.0 113.58 -175.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -54.33 -41.68 69.33 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 126.201 1.8 . . . . 0.0 110.164 169.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.14 -53.74 31.57 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 177.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -63.29 -39.57 94.95 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 117.264 0.532 . . . . 0.0 110.967 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -63.02 -48.18 79.9 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.334 0.654 . . . . 0.0 109.837 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.17 -19.53 66.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.44 0.534 . . . . 0.0 112.44 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.53 -35.7 22.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.787 0.835 . . . . 0.0 111.228 175.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.2 mt -61.07 150.37 78.92 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.618 0.767 . . . . 0.0 109.774 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.03 145.44 41.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.221 2.614 . . . . 0.0 112.803 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.52 -33.3 32.9 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.275 0.94 . . . . 0.0 112.804 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -67.64 -51.19 52.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.716 0.758 . . . . 0.0 110.97 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -62.01 -34.03 75.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -61.5 -58.6 7.5 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.024 0.529 . . . . 0.0 110.05 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -38.69 90.19 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.985 0.514 . . . . 0.0 110.465 -175.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -51.07 71.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.88 0.472 . . . . 0.0 110.202 175.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mmm -57.13 -39.15 74.59 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.927 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -57.62 -53.58 56.61 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.18 0.9 . . . . 0.0 110.505 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -56.95 -46.06 82.36 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.586 0.754 . . . . 0.0 111.692 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 . . . . . 0 N--CA 1.456 -0.161 0 C-N-CA 124.516 1.126 . . . . 0.0 110.905 -171.866 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.26 72.01 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.249 1.019 . . . . 0.0 111.457 172.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.51 -58.86 4.79 Favored 'General case' 0 CA--C 1.505 -0.759 0 C-N-CA 127.557 2.343 . . . . 0.0 107.785 173.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.5 t -59.24 -32.12 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 118.761 0.71 . . . . 0.0 111.2 -177.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.8 t -66.47 -46.29 76.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.031 0.378 . . . . 0.0 110.558 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.5 t -77.29 -32.44 18.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.297 1.439 . . . . 0.0 111.981 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -84.81 -39.39 18.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.929 1.692 . . . . 0.0 108.449 -173.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.22 16.89 70.62 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.2 pt -148.9 142.83 18.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.7 158.35 24.87 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -52.77 -41.56 64.18 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.226 1.81 . . . . 0.0 110.021 169.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.67 -54.12 30.71 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.13 -36.33 83.93 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 117.451 0.625 . . . . 0.0 110.974 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -61.67 -47.36 85.7 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.156 0.583 . . . . 0.0 109.974 177.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.79 -19.12 65.77 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.23 -36.23 22.89 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.731 0.812 . . . . 0.0 111.083 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 mt -61.31 153.1 70.13 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 123.893 0.877 . . . . 0.0 109.797 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.19 150.8 87.14 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.616 2.211 . . . . 0.0 111.195 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.42 -34.12 25.96 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.915 1.245 . . . . 0.0 112.808 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -68.53 -51.16 45.99 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.712 0.756 . . . . 0.0 110.751 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -62.31 -32.49 73.25 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -61.5 -57.22 13.01 Favored 'General case' 0 C--N 1.342 0.248 0 C-N-CA 123.308 0.643 . . . . 0.0 110.664 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.17 -38.56 91.51 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 122.701 0.401 . . . . 0.0 110.663 -176.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.87 -51.86 67.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.865 1.266 . . . . 0.0 109.958 176.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.9 mmm -59.32 -46.81 87.56 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.338 0.655 . . . . 0.0 111.627 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -54.58 -49.62 69.94 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.5 0.591 . . . . 0.0 111.349 177.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.3 mtmt -60.96 -47.37 86.76 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.849 0.295 . . . . 0.0 111.462 176.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 . . . . . 0 CA--C 1.527 0.087 0 C-N-CA 123.589 0.755 . . . . 0.0 111.473 -172.869 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.28 -39.03 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.87 0.868 . . . . 0.0 111.597 174.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -49.82 -56.02 11.99 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 127.298 2.239 . . . . 0.0 107.75 171.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.07 -30.73 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 119.197 0.908 . . . . 0.0 111.214 -177.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.81 -48.64 68.33 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.429 0.559 . . . . 0.0 110.232 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.1 t -73.42 -32.15 35.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 125.302 1.441 . . . . 0.0 112.023 -177.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -86.44 -23.25 26.11 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.169 1.787 . . . . 0.0 109.61 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.35 28.18 19.17 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 124.694 1.14 . . . . 0.0 112.82 -172.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 19.9 pt -145.29 143.74 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 172.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.24 158.88 27.76 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.903 0.858 . . . . 0.0 113.274 -176.554 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -54.67 -40.45 69.09 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.944 1.697 . . . . 0.0 109.9 170.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.6 -54.39 29.2 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.141 0.877 . . . . 0.0 110.92 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -64.35 -38.18 90.13 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 117.353 0.577 . . . . 0.0 110.859 -178.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.11 -49.66 77.02 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.611 0.764 . . . . 0.0 109.941 176.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.2 65.75 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.73 -34.07 21.31 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.93 0.892 . . . . 0.0 111.414 175.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -61.63 154.04 67.69 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.679 0.792 . . . . 0.0 110.452 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.09 144.77 36.33 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.312 2.674 . . . . 0.0 112.619 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.66 -32.78 40.34 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.014 0.816 . . . . 0.0 112.595 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -68.1 -51.47 46.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.718 0.759 . . . . 0.0 110.808 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -61.58 -32.99 73.12 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -61.78 -58.73 6.87 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.127 0.571 . . . . 0.0 110.508 176.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -37.49 86.01 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 122.721 0.408 . . . . 0.0 111.072 -176.338 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -54.43 47.09 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.957 1.303 . . . . 0.0 109.984 175.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.3 mmm -56.78 -43.39 80.82 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 119.159 -0.448 . . . . 0.0 111.559 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -59.7 -48.36 81.98 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 118.929 -0.558 . . . . 0.0 111.865 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.52 70.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.844 0.747 . . . . 0.0 111.722 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 109.682 -177.278 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.59 -41.09 89.47 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.217 1.008 . . . . 0.0 111.1 174.203 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.9 -52.25 61.13 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.328 3.051 . . . . 0.0 108.293 174.413 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -52.97 -30.99 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 119.884 1.22 . . . . 0.0 112.045 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.1 t -68.85 -46.65 67.94 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.825 0.739 . . . . 0.0 110.865 176.668 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 85.8 t -78.08 -28.61 15.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.762 1.625 . . . . 0.0 112.468 -174.854 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -94.31 -30.03 14.74 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 126.908 2.083 . . . . 0.0 110.146 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 50.52 26.87 10.72 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.98 0.8 . . . . 0.0 112.927 -169.704 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.12 141.31 41.93 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 CA-C-N 117.84 0.82 . . . . 0.0 109.372 169.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.39 161.32 29.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 125.007 1.323 . . . . 0.0 113.408 -176.769 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -54.22 -41.21 68.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.875 1.67 . . . . 0.0 109.762 169.832 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.75 -54.33 26.02 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 110.714 -0.955 . . . . 0.0 110.714 -179.779 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.44 -38.84 92.71 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.833 0.453 . . . . 0.0 111.058 -179.169 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.74 -47.73 82.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.29 0.636 . . . . 0.0 109.795 177.815 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.33 -19.54 66.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.74 -35.64 24.25 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.803 0.841 . . . . 0.0 110.977 175.436 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 mt -60.7 152.05 69.37 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.597 0.759 . . . . 0.0 109.682 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.78 144.22 44.64 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.977 2.451 . . . . 0.0 112.41 177.069 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -31.64 47.12 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 123.864 0.745 . . . . 0.0 112.509 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.0 p-90 -68.08 -50.98 51.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.668 0.734 . . . . 0.0 110.601 174.868 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 tptp -62.49 -31.78 72.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -176.801 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -62.2 -57.98 9.46 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.324 0.65 . . . . 0.0 110.58 176.155 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.58 84.53 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.886 0.475 . . . . 0.0 110.551 -176.216 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -58.47 -53.08 62.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.696 1.198 . . . . 0.0 109.646 175.294 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.8 mmm -58.78 -45.34 90.06 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.945 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -53.34 -52.47 59.11 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.456 0.571 . . . . 0.0 111.134 174.741 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -60.39 -43.09 96.96 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.584 0.754 . . . . 0.0 111.611 178.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.122 0 C-N-CA 124.053 0.941 . . . . 0.0 110.868 -171.907 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.85 -37.26 63.46 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.375 1.07 . . . . 0.0 110.712 172.292 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -52.43 -58.7 5.89 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 127.216 2.207 . . . . 0.0 107.881 170.299 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -59.16 -31.99 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 118.778 0.717 . . . . 0.0 110.939 -176.81 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -65.28 -49.03 71.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.023 0.374 . . . . 0.0 110.455 177.439 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.3 t -75.16 -33.48 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.449 1.1 . . . . 0.0 111.868 -177.069 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -80.86 -34.71 33.54 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.054 1.742 . . . . 0.0 108.819 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.49 16.0 74.71 Favored Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 177.583 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.7 pt -151.31 144.9 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 -175.425 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.28 158.32 29.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.0 0.905 . . . . 0.0 113.235 -177.591 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.8 ttt180 -53.83 -39.6 65.7 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.281 1.832 . . . . 0.0 110.086 170.42 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.93 -54.84 27.99 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.07 0.843 . . . . 0.0 111.042 177.176 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.01 -36.56 84.77 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 117.437 0.619 . . . . 0.0 110.954 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -59.76 -48.86 79.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.817 0.847 . . . . 0.0 109.994 175.056 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.15 -19.38 65.95 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 178.459 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.64 -34.95 22.97 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.836 0.854 . . . . 0.0 111.353 175.193 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.04 152.89 58.81 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.57 0.748 . . . . 0.0 110.275 179.249 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.13 144.49 37.7 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.24 2.627 . . . . 0.0 112.514 177.552 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.17 -32.13 42.77 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 123.988 0.804 . . . . 0.0 112.496 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -68.29 -50.69 51.93 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.685 0.743 . . . . 0.0 110.734 175.157 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -61.94 -32.96 73.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.782 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -61.11 -57.69 11.47 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.883 0.473 . . . . 0.0 110.599 176.712 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -38.58 91.69 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.519 0.328 . . . . 0.0 110.684 -177.149 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -52.33 63.87 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.303 1.441 . . . . 0.0 109.691 175.965 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.2 mmm -58.7 -49.09 78.86 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.511 0.596 . . . . 0.0 111.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -57.4 -47.24 82.24 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.569 0.348 . . . . 0.0 111.268 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtmt -62.35 -44.71 95.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.852 0.461 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 C--N 1.339 0.129 0 C-N-CA 124.734 1.213 . . . . 0.0 111.588 -172.979 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.18 -39.39 86.34 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.476 0.58 . . . . 0.0 111.63 174.304 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -51.52 -61.41 2.26 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 127.171 2.188 . . . . 0.0 107.367 170.958 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -53.14 -38.86 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.048 0.84 . . . . 0.0 112.342 178.721 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.9 t -62.05 -39.78 93.53 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 117.918 0.326 . . . . 0.0 111.463 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -89.32 -30.46 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.479 1.512 . . . . 0.0 111.823 -175.132 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.77 -39.37 18.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.095 1.358 . . . . 0.0 108.815 -169.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.13 23.63 56.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.072 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -130.39 -165.6 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 172.833 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.03 159.17 25.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 124.939 1.296 . . . . 0.0 112.499 170.755 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -50.46 -41.17 52.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.162 2.185 . . . . 0.0 110.239 169.877 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.26 -53.83 30.63 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 179.149 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -59.81 -45.46 92.28 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.025 0.53 . . . . 0.0 110.758 178.792 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -61.41 -44.91 96.33 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.326 0.65 . . . . 0.0 110.139 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -18.44 65.33 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 178.638 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -33.83 15.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.059 0.944 . . . . 0.0 111.311 176.765 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -62.5 152.73 79.67 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.691 0.797 . . . . 0.0 110.668 -176.237 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -52.54 144.62 40.84 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.355 2.703 . . . . 0.0 112.544 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.34 -32.94 45.51 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.982 0.801 . . . . 0.0 112.638 178.042 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -68.67 -49.18 61.11 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.774 0.787 . . . . 0.0 110.718 175.26 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -61.92 -32.87 73.31 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -62.52 -58.06 8.92 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.198 0.599 . . . . 0.0 110.344 176.833 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 -35.79 81.79 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.798 0.439 . . . . 0.0 110.978 -177.085 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -56.27 -55.39 33.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.875 1.67 . . . . 0.0 110.096 175.336 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.6 mmm -56.24 -46.48 79.55 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.777 0.431 . . . . 0.0 110.915 177.468 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -56.7 -50.03 73.37 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 178.163 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -71.12 -30.97 67.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.65 0.659 . . . . 0.0 111.287 -177.108 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.164 0.585 . . . . 0.0 110.898 -177.694 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.09 -37.97 67.51 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.408 0.623 . . . . 0.0 110.085 174.498 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -49.93 -59.65 3.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 127.549 2.34 . . . . 0.0 107.958 169.927 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.2 t -58.76 -32.76 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 119.101 0.864 . . . . 0.0 110.881 -177.388 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.3 t -65.25 -45.43 84.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.016 0.371 . . . . 0.0 110.822 178.628 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.3 t -80.3 -33.37 14.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.376 1.07 . . . . 0.0 111.718 -176.954 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -79.83 -35.2 38.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.988 1.715 . . . . 0.0 108.634 -175.736 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.33 15.89 75.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 177.711 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.0 pt -150.28 144.01 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.165 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.95 158.43 30.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 122.102 0.953 . . . . 0.0 113.237 -176.731 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -52.54 -39.86 61.89 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 126.456 1.902 . . . . 0.0 110.217 169.967 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.03 -55.3 25.01 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.139 0.876 . . . . 0.0 111.05 177.597 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.14 -35.68 81.86 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 117.357 0.578 . . . . 0.0 111.042 -178.246 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -60.7 -48.38 82.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.648 0.779 . . . . 0.0 110.005 175.298 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.24 65.84 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.224 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.4 -35.13 23.33 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.834 0.854 . . . . 0.0 111.211 175.117 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.25 152.92 60.93 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 123.54 0.736 . . . . 0.0 110.339 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.61 144.51 41.9 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.225 2.617 . . . . 0.0 112.578 177.722 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.86 -32.68 41.6 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.057 0.837 . . . . 0.0 112.591 177.999 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -68.26 -50.39 54.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.634 0.717 . . . . 0.0 110.779 175.32 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -62.07 -33.0 73.6 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.17 -57.44 12.46 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.04 0.536 . . . . 0.0 110.71 176.98 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -39.4 94.22 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.545 0.338 . . . . 0.0 110.651 -177.219 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -54.35 -53.35 55.08 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.217 1.407 . . . . 0.0 109.489 175.634 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 45.8 mmm -58.41 -47.48 83.79 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 111.58 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -55.61 -49.62 72.33 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.392 0.277 . . . . 0.0 111.404 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -64.06 -42.64 96.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 178.15 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 125.002 1.321 . . . . 0.0 112.271 -173.358 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 . . . . . 0 CA--C 1.537 0.446 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -58.84 -34.46 71.58 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.038 0.935 . . . . 0.0 110.464 173.679 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -57.92 -58.93 6.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.637 1.975 . . . . 0.0 107.205 171.53 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.99 -38.13 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 119.46 1.027 . . . . 0.0 111.965 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.2 t -61.37 -45.62 93.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.909 0.322 . . . . 0.0 111.197 178.863 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.79 -34.11 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.934 1.294 . . . . 0.0 111.984 -175.239 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -85.14 -36.25 21.2 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.524 1.53 . . . . 0.0 109.01 -170.622 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.83 7.4 88.04 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 178.494 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.0 pt -139.21 146.99 24.95 Favored 'Isoleucine or valine' 0 C--N 1.341 0.233 0 CA-C-N 117.786 0.793 . . . . 0.0 110.162 -177.725 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -62.54 156.91 21.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 122.174 0.988 . . . . 0.0 113.02 -177.286 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.8 ttp180 -57.39 -39.05 75.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.22 -1.809 . . . . 0.0 108.805 172.0 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.44 -53.18 33.8 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.352 0.977 . . . . 0.0 111.105 177.716 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -64.91 -36.66 85.1 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 117.815 0.807 . . . . 0.0 110.779 -178.031 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -60.91 -48.33 82.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.788 0.435 . . . . 0.0 110.608 176.092 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.38 65.85 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 178.026 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.62 -35.79 22.46 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.801 0.84 . . . . 0.0 111.142 175.069 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.24 150.45 79.48 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.568 0.747 . . . . 0.0 109.858 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.14 144.46 37.88 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.164 2.576 . . . . 0.0 112.493 176.909 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.69 -32.0 46.38 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.912 0.768 . . . . 0.0 112.608 178.122 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -67.57 -50.61 57.59 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.78 0.79 . . . . 0.0 110.612 174.463 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.04 -32.25 72.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.656 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.75 -57.54 11.51 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 122.83 0.452 . . . . 0.0 110.481 176.487 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -37.18 86.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.705 0.402 . . . . 0.0 110.873 -176.524 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -53.53 55.94 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.315 1.446 . . . . 0.0 109.451 173.979 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.9 mmm -57.66 -42.63 83.93 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.525 0.602 . . . . 0.0 111.334 178.699 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -57.57 -52.03 67.08 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.708 177.488 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.36 -35.32 77.56 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.313 0.506 . . . . 0.0 111.514 -176.934 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -175.783 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.024 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -81.74 39.7 0.56 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.86 1.264 . . . . 0.0 111.639 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -172.7 130.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.063 1.745 . . . . 0.0 108.103 -177.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 m -44.14 146.88 0.58 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.378 1.871 . . . . 0.0 111.356 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -55.19 -28.6 54.17 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.756 0.823 . . . . 0.0 111.958 -175.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.51 -46.59 15.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.509 0.723 . . . . 0.0 111.576 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.69 -37.32 75.79 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.304 1.042 . . . . 0.0 110.285 175.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -54.38 -60.87 2.76 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 127.51 2.324 . . . . 0.0 107.427 171.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.4 t -51.62 -38.92 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.33 0.968 . . . . 0.0 112.513 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -62.68 -41.72 99.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.186 0.448 . . . . 0.0 111.524 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.2 t -84.53 -31.82 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.465 1.506 . . . . 0.0 112.124 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -87.23 -31.81 20.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.894 1.678 . . . . 0.0 109.717 -170.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.0 20.76 64.48 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -132.59 -168.07 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.48 157.02 23.5 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 124.948 1.299 . . . . 0.0 112.253 169.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -54.27 -38.97 66.44 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.009 172.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.58 -54.83 20.59 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -62.55 -37.6 86.76 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.075 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -62.5 -47.81 82.33 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.545 0.738 . . . . 0.0 110.131 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -19.22 65.78 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.24 -35.55 21.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.893 0.877 . . . . 0.0 111.191 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -60.6 151.71 69.82 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 123.513 0.725 . . . . 0.0 110.138 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.24 144.46 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.223 2.615 . . . . 0.0 112.524 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.92 -31.78 47.75 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.848 0.737 . . . . 0.0 112.565 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.9 p-90 -67.87 -49.95 59.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 117.747 0.773 . . . . 0.0 110.768 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.63 -34.37 75.55 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -60.2 -57.7 11.7 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 122.708 0.403 . . . . 0.0 110.527 177.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -36.69 84.86 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.878 0.471 . . . . 0.0 110.928 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -53.92 49.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 174.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 83.0 mtp -59.36 -46.01 89.82 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.876 0.762 . . . . 0.0 112.243 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -52.73 -53.13 52.09 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.037 0.38 . . . . 0.0 110.558 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -66.15 -37.76 86.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.759 0.824 . . . . 0.0 112.648 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -60.46 -43.53 96.79 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 124.426 1.09 . . . . 0.0 111.534 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.2 mptp? -59.17 -29.46 67.47 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.95 0.341 . . . . 0.0 111.162 173.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.4 -91.58 0.13 Allowed Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -164.28 31.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.901 1.28 . . . . 0.0 111.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.9 t80 . . . . . 0 C--O 1.25 1.093 0 C-N-CA 127.403 2.281 . . . . 0.0 112.474 -174.143 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.041 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -84.09 24.6 0.92 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.612 1.165 . . . . 0.0 112.012 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -168.6 129.48 1.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.467 1.507 . . . . 0.0 108.139 -170.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.9 p -47.85 151.45 0.9 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.0 1.32 . . . . 0.0 111.059 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.67 -23.32 40.94 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -82.78 -48.09 11.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.222 1.009 . . . . 0.0 111.946 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.03 -32.67 71.12 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.436 0.694 . . . . 0.0 110.157 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -51.99 -56.64 13.0 Favored 'General case' 0 C--O 1.215 -0.717 0 C-N-CA 127.629 2.372 . . . . 0.0 108.13 171.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -54.97 -30.34 23.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 119.156 0.889 . . . . 0.0 111.687 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -68.25 -47.52 67.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.625 0.648 . . . . 0.0 110.898 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.2 t -77.28 -32.74 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.081 1.353 . . . . 0.0 112.138 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -87.53 -42.69 12.57 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.382 1.873 . . . . 0.0 108.614 -172.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.61 7.87 87.62 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.812 -0.994 . . . . 0.0 110.861 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.4 pt -137.1 142.33 37.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.302 1.051 . . . . 0.0 110.857 -176.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.26 162.56 28.24 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 126.346 1.859 . . . . 0.0 114.624 -175.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -44.89 54.66 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.536 2.334 . . . . 0.0 109.301 169.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.53 -54.81 31.27 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -67.98 -34.71 77.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.998 0.399 . . . . 0.0 111.527 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.96 -45.94 79.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -19.46 65.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.87 -36.99 24.94 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.591 0.756 . . . . 0.0 110.85 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.62 148.67 81.01 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 123.368 0.667 . . . . 0.0 109.888 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.34 146.38 32.46 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.356 2.704 . . . . 0.0 112.939 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -33.54 49.99 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.051 0.834 . . . . 0.0 112.682 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -65.05 -52.87 53.36 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 117.91 0.855 . . . . 0.0 110.06 173.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -62.46 -32.26 73.11 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 -174.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -61.93 -58.12 9.14 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 122.955 0.502 . . . . 0.0 110.962 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -36.39 81.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.86 0.464 . . . . 0.0 110.273 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.16 -51.62 60.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.853 1.661 . . . . 0.0 110.978 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mtp -49.96 -49.63 49.55 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.036 0.834 . . . . 0.0 111.475 175.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.8 mtpt -53.82 -48.09 70.25 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.142 0.428 . . . . 0.0 111.423 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.07 -44.76 95.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.819 0.448 . . . . 0.0 111.931 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -69.59 -51.7 32.8 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.879 0.871 . . . . 0.0 110.734 -169.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.22 -37.97 56.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.371 1.068 . . . . 0.0 110.758 169.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.69 -90.86 0.01 OUTLIER Glycine 0 CA--C 1.533 1.178 0 C-N-CA 124.632 1.111 . . . . 0.0 111.115 169.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -158.49 28.78 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.77 0.828 . . . . 0.0 112.683 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 t80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.696 1.198 . . . . 0.0 110.39 -179.88 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.038 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -61.97 -33.58 74.57 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.911 0.884 . . . . 0.0 112.962 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -167.89 129.56 1.47 Allowed 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 128.325 2.65 . . . . 0.0 107.542 171.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 p -49.62 154.97 0.87 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.665 1.186 . . . . 0.0 111.434 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.56 -25.01 59.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.249 0.619 . . . . 0.0 111.708 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.8 -49.77 10.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.315 1.046 . . . . 0.0 111.792 174.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.12 -36.42 72.89 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.463 0.705 . . . . 0.0 110.169 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.873 ' CZ ' ' CD2' ' A' ' 11' ' ' PHE . 3.3 t80 -51.43 -57.79 8.02 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 127.642 2.377 . . . . 0.0 107.455 172.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 t -59.27 -31.59 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-N 119.1 0.864 . . . . 0.0 111.217 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.88 -48.56 68.4 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.141 0.428 . . . . 0.0 110.52 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.8 -32.96 36.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.331 1.452 . . . . 0.0 112.072 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.873 ' CD2' ' CZ ' ' A' ' 7' ' ' PHE . 7.1 m-85 -83.65 -38.74 21.13 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 125.935 1.694 . . . . 0.0 108.296 -174.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.25 17.72 68.55 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.4 pt -150.06 143.37 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.93 158.97 26.68 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.3 ttt180 -52.54 -41.88 63.9 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.793 2.037 . . . . 0.0 110.094 169.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.31 29.09 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -65.16 -36.49 84.4 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.292 0.546 . . . . 0.0 111.085 -177.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -62.15 -48.5 79.81 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.058 0.543 . . . . 0.0 109.691 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.27 65.84 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.52 -35.57 22.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.895 0.878 . . . . 0.0 111.297 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.26 151.96 74.24 Favored Pre-proline 0 CA--C 1.536 0.419 0 C-N-CA 123.549 0.74 . . . . 0.0 110.202 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.47 146.11 43.55 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.202 2.601 . . . . 0.0 112.864 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.29 -33.93 32.26 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.439 1.018 . . . . 0.0 112.749 177.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.68 -51.44 49.59 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 117.766 0.783 . . . . 0.0 110.979 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -61.91 -33.82 74.94 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -61.92 -57.61 11.08 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.239 0.616 . . . . 0.0 110.343 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -39.26 93.48 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.7 0.4 . . . . 0.0 110.411 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -59.17 -52.9 63.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.007 0.523 . . . . 0.0 110.179 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 53.7 mmm -55.25 -44.08 75.2 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.371 0.668 . . . . 0.0 112.313 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -56.07 -51.67 67.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.374 0.533 . . . . 0.0 111.087 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -60.3 -45.35 93.66 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.858 0.463 . . . . 0.0 111.628 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.71 -55.27 21.01 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.347 1.059 . . . . 0.0 110.843 -173.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -58.02 -30.04 65.79 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.581 0.752 . . . . 0.0 110.46 173.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.3 -88.91 0.02 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.707 1.146 . . . . 0.0 110.28 168.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.3 36.17 0.2 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.599 0.76 . . . . 0.0 111.896 -173.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.106 -179.999 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.03 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -86.52 25.22 1.26 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.76 1.224 . . . . 0.0 111.655 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -175.09 130.28 0.3 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.994 2.118 . . . . 0.0 107.26 -173.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.8 m -45.39 140.85 2.88 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.351 1.461 . . . . 0.0 111.093 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.17 -26.28 16.58 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.752 1.221 . . . . 0.0 112.933 -170.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 -80.74 -49.39 11.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.843 0.857 . . . . 0.0 111.716 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.76 -39.91 62.65 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.555 1.142 . . . . 0.0 111.758 172.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -52.35 -58.23 7.34 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 128.068 2.547 . . . . 0.0 107.884 174.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.28 -32.14 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 118.674 0.67 . . . . 0.0 110.998 -176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -66.28 -45.02 81.9 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.102 0.41 . . . . 0.0 110.673 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.7 t -77.79 -33.45 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.235 1.414 . . . . 0.0 111.99 -177.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -84.42 -38.57 20.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.784 1.633 . . . . 0.0 108.647 -173.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.39 16.95 70.05 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.9 pt -149.58 142.61 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.13 158.78 25.0 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -53.54 -41.01 65.98 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 126.19 1.796 . . . . 0.0 110.07 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.07 -53.62 29.0 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.84 -38.33 90.35 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.116 0.458 . . . . 0.0 111.012 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -62.31 -47.22 85.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.405 0.682 . . . . 0.0 109.875 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -19.33 65.87 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.59 -35.75 22.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.756 0.822 . . . . 0.0 111.153 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.94 153.04 67.68 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 123.852 0.861 . . . . 0.0 109.967 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.55 150.31 86.75 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.627 2.218 . . . . 0.0 111.252 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.37 -34.54 26.42 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.938 1.256 . . . . 0.0 112.853 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.7 p-90 -69.03 -49.66 55.63 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.747 0.773 . . . . 0.0 111.115 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -61.62 -35.4 77.77 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -60.68 -58.16 9.64 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 122.819 0.448 . . . . 0.0 110.202 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -39.39 92.97 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.793 0.437 . . . . 0.0 110.592 -176.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -56.34 -53.84 52.56 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.947 0.499 . . . . 0.0 109.836 175.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.7 mmm -56.84 -41.45 77.9 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.713 0.805 . . . . 0.0 112.246 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.26 -53.18 60.29 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.866 0.757 . . . . 0.0 110.838 175.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -59.76 -45.06 93.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.193 0.597 . . . . 0.0 111.49 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -67.23 -52.93 34.99 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.601 1.16 . . . . 0.0 110.617 -172.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -60.76 -28.56 68.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.093 0.557 . . . . 0.0 110.532 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.31 -89.97 0.02 OUTLIER Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.769 1.176 . . . . 0.0 110.407 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -165.16 29.82 0.06 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.842 0.857 . . . . 0.0 111.824 -174.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.1 t80 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 117.2 -1.381 . . . . 0.0 110.206 -177.002 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.012 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -86.75 23.99 1.57 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.614 1.166 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -174.24 130.68 0.38 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.628 1.971 . . . . 0.0 107.528 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 m -44.19 141.84 1.66 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.323 1.449 . . . . 0.0 111.032 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.85 -23.89 33.45 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.19 0.996 . . . . 0.0 113.005 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -81.11 -49.96 10.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.968 0.907 . . . . 0.0 111.701 173.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.8 -33.62 66.86 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.748 1.219 . . . . 0.0 110.921 174.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -54.76 -57.1 12.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 127.375 2.27 . . . . 0.0 107.77 172.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -60.05 -33.13 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 118.807 0.731 . . . . 0.0 110.737 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 t -63.44 -48.65 76.85 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.012 0.369 . . . . 0.0 110.438 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 75.4 t -75.77 -32.94 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.584 1.154 . . . . 0.0 111.87 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.93 -24.72 28.26 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.993 1.717 . . . . 0.0 109.713 -173.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.38 28.51 20.49 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.645 1.117 . . . . 0.0 112.777 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.5 pt -144.91 141.75 23.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -66.5 159.39 27.33 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -176.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -53.95 -42.05 68.44 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 126.491 1.916 . . . . 0.0 110.19 169.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.26 -52.9 32.53 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -62.66 -40.47 97.15 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 116.972 0.386 . . . . 0.0 110.925 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.82 -49.34 78.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.353 0.661 . . . . 0.0 109.588 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -18.93 65.32 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.05 -33.86 19.38 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.006 0.922 . . . . 0.0 111.426 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.03 154.36 69.34 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 123.801 0.841 . . . . 0.0 110.571 -177.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.22 145.75 33.85 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.291 2.661 . . . . 0.0 112.653 176.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.61 -33.82 42.11 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.063 0.839 . . . . 0.0 112.658 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -67.25 -51.39 53.69 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 117.724 0.762 . . . . 0.0 110.679 175.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.02 -32.83 73.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.4 -58.85 6.54 Favored 'General case' 0 C--N 1.34 0.168 0 O-C-N 121.952 -0.467 . . . . 0.0 110.545 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.15 -38.52 89.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.661 0.384 . . . . 0.0 110.608 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -57.62 -55.63 32.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.606 1.563 . . . . 0.0 110.5 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 73.8 mmm -56.88 -44.16 81.99 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.63 0.65 . . . . 0.0 111.913 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -56.41 -52.07 66.01 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.371 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.08 -43.37 92.38 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.045 0.384 . . . . 0.0 111.443 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -69.19 -46.65 66.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.245 0.618 . . . . 0.0 111.035 -169.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -27.55 68.54 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.307 0.243 . . . . 0.0 110.35 173.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.1 -89.86 0.04 OUTLIER Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.027 1.299 . . . . 0.0 111.392 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -156.16 41.8 0.38 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.356 1.462 . . . . 0.0 110.629 -170.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.8 t80 . . . . . 0 C--O 1.251 1.174 0 C-N-CA 128.927 2.891 . . . . 0.0 111.068 -178.496 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.025 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 49.8 p90 -81.84 31.22 0.37 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.95 1.3 . . . . 0.0 111.924 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -170.03 130.58 0.98 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.84 2.056 . . . . 0.0 106.525 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 m -44.94 138.11 3.77 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.809 1.244 . . . . 0.0 110.173 -175.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -59.06 -20.19 51.09 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -81.86 -49.27 10.54 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.873 0.869 . . . . 0.0 111.377 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.58 -37.74 65.89 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.035 1.334 . . . . 0.0 110.988 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -52.33 -57.47 9.67 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 127.407 2.283 . . . . 0.0 108.131 172.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -61.12 -31.58 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 118.359 0.527 . . . . 0.0 110.705 -176.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.0 t -64.99 -44.85 87.95 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.963 0.347 . . . . 0.0 110.658 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.1 t -79.84 -34.95 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.475 1.11 . . . . 0.0 111.786 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -79.8 -32.72 40.79 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.823 1.649 . . . . 0.0 108.775 -175.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.79 15.31 75.74 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 pt -151.86 146.57 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -175.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.22 158.2 29.47 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -53.41 -39.86 64.66 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.102 -1.863 . . . . 0.0 109.87 170.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.4 -54.28 30.48 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.177 0.894 . . . . 0.0 111.08 177.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.89 -36.15 83.43 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 117.511 0.656 . . . . 0.0 110.972 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.48 -48.64 80.88 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.421 0.689 . . . . 0.0 110.146 175.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.81 -19.29 65.77 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.83 -34.99 22.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.855 0.862 . . . . 0.0 111.351 175.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.32 153.03 61.09 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.59 0.756 . . . . 0.0 110.373 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.72 144.76 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.227 2.618 . . . . 0.0 112.735 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.54 -32.84 39.59 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.088 0.851 . . . . 0.0 112.62 177.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -68.18 -50.59 53.34 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 117.766 0.783 . . . . 0.0 110.844 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.9 -35.07 75.71 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.16 -57.95 10.61 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.695 0.398 . . . . 0.0 110.576 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -37.22 86.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.896 0.478 . . . . 0.0 110.654 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -57.13 -54.58 45.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.113 1.365 . . . . 0.0 110.284 177.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.0 mtp -55.61 -45.52 77.5 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 118.16 0.436 . . . . 0.0 111.603 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.36 -49.14 78.28 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 119.274 -0.394 . . . . 0.0 111.625 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -70.62 -29.24 65.57 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.538 0.608 . . . . 0.0 111.974 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -68.63 -50.6 50.08 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.937 0.895 . . . . 0.0 110.646 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -58.04 -29.3 65.25 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.613 0.365 . . . . 0.0 110.778 169.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.74 -91.83 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.387 0.994 . . . . 0.0 110.621 169.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -166.14 24.85 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.417 0.687 . . . . 0.0 112.424 -175.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 t80 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.441 -1.266 . . . . 0.0 109.436 -175.17 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.015 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -152.55 111.67 3.84 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.958 0.903 . . . . 0.0 108.75 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.0 mp 52.88 85.61 0.05 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.647 1.579 . . . . 0.0 112.943 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 p -68.15 149.63 49.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 168.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.02 -25.28 60.93 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.306 0.242 . . . . 0.0 111.514 -174.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -81.49 -50.76 9.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.233 1.013 . . . . 0.0 112.505 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.38 -37.03 76.91 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.664 0.665 . . . . 0.0 111.487 176.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -47.69 -57.53 5.41 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 126.795 2.038 . . . . 0.0 107.929 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -60.3 -31.36 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 119.184 0.902 . . . . 0.0 111.101 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 t -67.25 -45.73 75.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.157 0.435 . . . . 0.0 110.547 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.2 t -75.87 -33.69 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.257 1.423 . . . . 0.0 111.755 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -82.74 -38.23 23.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.425 1.49 . . . . 0.0 108.583 -173.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.28 18.23 67.28 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.0 pt -150.4 143.28 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.37 159.52 26.7 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -175.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -53.6 -41.29 66.47 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.832 1.653 . . . . 0.0 110.15 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.49 -53.84 29.73 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.58 -39.39 93.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.025 0.412 . . . . 0.0 110.924 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -61.31 -48.93 79.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.647 0.779 . . . . 0.0 109.834 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.4 65.91 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.15 -34.78 22.04 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.874 0.869 . . . . 0.0 111.362 175.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -60.98 152.64 69.78 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.685 0.794 . . . . 0.0 110.283 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.36 144.69 39.03 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.272 2.648 . . . . 0.0 112.588 177.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.81 -32.74 41.33 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 123.989 0.804 . . . . 0.0 112.67 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.87 -50.83 54.2 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 117.68 0.74 . . . . 0.0 110.764 174.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.0 -32.62 73.11 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -177.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -61.44 -56.65 17.85 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 122.921 0.488 . . . . 0.0 110.571 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.43 -39.66 94.26 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.431 0.292 . . . . 0.0 110.615 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -51.4 64.36 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.254 1.422 . . . . 0.0 109.814 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 60.7 mmm -61.94 -44.0 97.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.65 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -54.86 -52.25 63.4 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.644 0.656 . . . . 0.0 111.121 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.77 -48.55 80.83 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 111.652 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 -65.67 -53.91 34.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 111.023 -173.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -58.05 -31.04 66.65 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.355 0.525 . . . . 0.0 110.771 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.72 -89.42 0.02 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.76 1.172 . . . . 0.0 110.94 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -93.43 42.35 1.1 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.961 1.304 . . . . 0.0 112.707 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.3 p90 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 124.632 1.173 . . . . 0.0 113.084 169.813 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.06 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 14.0 t80 59.73 -154.06 0.37 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.864 1.266 . . . . 0.0 110.431 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -164.83 127.97 2.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.701 1.6 . . . . 0.0 107.795 -175.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.4 m -50.35 148.4 3.67 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.282 1.433 . . . . 0.0 110.548 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -60.43 -16.11 32.96 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -174.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -80.45 -50.61 9.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 111.426 170.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.51 -33.69 73.0 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.457 1.103 . . . . 0.0 110.733 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -53.31 -52.96 57.44 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 128.98 2.912 . . . . 0.0 108.141 171.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 t -57.21 -32.92 41.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 119.382 0.992 . . . . 0.0 111.049 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.2 t -68.55 -24.11 64.59 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.6 t -105.22 -32.54 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.889 1.675 . . . . 0.0 111.425 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -86.06 -38.82 17.42 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.94 2.096 . . . . 0.0 108.738 -175.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.89 11.59 82.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.075 -0.847 . . . . 0.0 111.155 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.3 pt -142.46 142.12 27.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 118.013 0.907 . . . . 0.0 109.45 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.99 157.92 29.59 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.99 0.9 . . . . 0.0 113.083 -176.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -52.69 -40.11 62.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 126.587 1.955 . . . . 0.0 110.063 170.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.25 -55.16 27.63 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -66.28 -37.66 85.95 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 117.288 0.544 . . . . 0.0 110.701 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -60.38 -48.94 79.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.618 0.767 . . . . 0.0 109.923 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.03 -19.27 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.59 -34.69 21.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.891 0.876 . . . . 0.0 111.317 175.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.31 152.67 71.92 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.817 0.847 . . . . 0.0 110.249 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -51.79 144.98 32.96 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.322 2.682 . . . . 0.0 112.623 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.94 -33.28 43.43 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 123.944 0.783 . . . . 0.0 112.58 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.4 p-90 -68.59 -48.95 62.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.742 0.771 . . . . 0.0 110.752 175.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -62.03 -32.98 73.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.29 -57.67 10.53 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.062 0.545 . . . . 0.0 110.533 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.71 -38.83 92.58 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.57 0.348 . . . . 0.0 110.733 -177.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -51.67 -57.13 10.07 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.283 1.433 . . . . 0.0 109.43 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 69.2 mmm -59.31 -47.05 86.87 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 111.694 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -54.19 -50.18 67.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.466 0.575 . . . . 0.0 111.525 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -60.67 -54.46 45.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.527 0.331 . . . . 0.0 111.273 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -60.7 -47.14 87.59 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.948 1.299 . . . . 0.0 112.107 -169.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -29.79 69.36 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.674 0.39 . . . . 0.0 110.555 175.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.93 -89.72 0.06 OUTLIER Glycine 0 CA--C 1.532 1.107 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -158.0 24.91 0.26 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.92 1.288 . . . . 0.0 111.055 -177.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 125.914 1.686 . . . . 0.0 109.925 -169.523 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.008 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -86.35 23.12 1.65 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.547 1.139 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -172.29 129.96 0.59 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.556 1.942 . . . . 0.0 107.554 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.6 p -49.57 148.76 2.68 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.737 0.815 . . . . 0.0 110.447 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -62.02 -15.53 44.98 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -81.64 -50.71 9.0 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.43 1.092 . . . . 0.0 111.774 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -57.26 -34.75 68.95 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.717 0.807 . . . . 0.0 110.161 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -53.33 -58.52 6.82 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 127.908 2.483 . . . . 0.0 107.91 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.7 t -53.84 -32.47 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 118.733 0.697 . . . . 0.0 111.826 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -66.77 -45.53 78.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.495 0.589 . . . . 0.0 110.914 177.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -80.86 -32.8 12.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 125.464 1.506 . . . . 0.0 112.342 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -88.93 -38.09 14.76 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.881 2.073 . . . . 0.0 108.862 -173.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.2 8.52 86.33 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.907 -0.941 . . . . 0.0 111.258 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.5 pt -141.95 142.75 27.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.323 0 CA-C-N 118.153 0.977 . . . . 0.0 110.493 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.45 160.22 25.39 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 125.268 1.427 . . . . 0.0 113.933 -174.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -51.08 -44.08 61.14 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.801 2.041 . . . . 0.0 109.052 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -53.56 32.16 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -64.0 -37.65 88.21 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.902 0.351 . . . . 0.0 110.995 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -66.69 -45.9 77.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -19.5 65.98 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.18 -36.71 24.47 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.647 0.779 . . . . 0.0 111.01 174.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.28 148.8 84.61 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 123.356 0.662 . . . . 0.0 110.043 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.48 145.22 47.68 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.275 2.65 . . . . 0.0 112.96 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.68 -33.03 33.56 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.296 0.951 . . . . 0.0 112.961 177.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 13.3 p-90 -68.2 -49.89 57.83 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 117.811 0.806 . . . . 0.0 111.025 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.54 -37.51 81.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -59.6 -58.28 9.29 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.556 0.342 . . . . 0.0 110.182 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -38.11 86.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.779 0.432 . . . . 0.0 110.633 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -59.9 -51.58 69.11 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.075 0.55 . . . . 0.0 110.611 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.5 mtp -54.62 -42.09 70.78 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.305 176.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.57 -52.58 64.26 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.012 0.823 . . . . 0.0 111.226 178.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -68.53 -32.49 72.47 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.36 -54.67 8.77 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.885 0.874 . . . . 0.0 110.75 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -59.87 -28.56 67.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.134 0.573 . . . . 0.0 110.058 172.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.89 -90.12 0.01 OUTLIER Glycine 0 CA--C 1.528 0.906 0 C-N-CA 125.413 1.483 . . . . 0.0 110.607 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.47 27.97 0.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -173.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.3 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.793 179.359 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.133 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -57.99 114.74 2.48 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.876 0.87 . . . . 0.0 109.698 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.1 mp 51.0 69.46 0.64 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.106 1.363 . . . . 0.0 110.812 -174.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 74.8 m -60.76 134.62 57.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 168.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -46.94 -33.27 4.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.209 1.404 . . . . 0.0 112.695 -169.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 -79.57 -46.35 17.47 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.314 0.646 . . . . 0.0 112.108 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.59 -40.96 80.22 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.762 0.825 . . . . 0.0 111.13 173.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.648 ' HZ ' ' CD1' ' A' ' 18' ' ' PHE . 3.3 t80 -53.1 -58.01 8.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 126.982 2.113 . . . . 0.0 107.822 171.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.3 t -58.1 -34.65 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 119.574 1.079 . . . . 0.0 111.673 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.7 t -64.4 -42.27 96.19 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.511 0.596 . . . . 0.0 111.235 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t -80.94 -35.83 14.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 124.9 1.28 . . . . 0.0 111.431 -176.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.0 -45.14 13.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.188 1.395 . . . . 0.0 109.693 -172.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.5 15.18 76.77 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.816 -0.991 . . . . 0.0 111.03 -173.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.1 pt -110.46 -160.08 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.403 0 CA-C-N 118.301 1.051 . . . . 0.0 108.305 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.65 158.13 30.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.217 1.407 . . . . 0.0 112.853 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -55.14 -39.09 69.06 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 113.12 -1.854 . . . . 0.0 110.56 170.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.99 -55.35 28.67 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.9 -42.46 99.79 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 117.053 0.427 . . . . 0.0 110.705 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.648 ' CD1' ' HZ ' ' A' ' 7' ' ' PHE . 46.8 t80 -57.02 -45.62 82.95 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.042 0.937 . . . . 0.0 111.043 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.43 -19.08 65.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.07 -28.27 22.65 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.927 0.891 . . . . 0.0 111.431 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.06 144.93 90.33 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 177.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -54.07 143.81 60.67 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.298 1.998 . . . . 0.0 111.662 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.19 -32.13 50.28 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 123.384 0.516 . . . . 0.0 112.559 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -65.93 -50.5 64.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.644 0.722 . . . . 0.0 110.676 174.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -60.88 -35.11 75.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -62.07 -54.53 40.14 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.869 0.468 . . . . 0.0 110.546 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.21 -40.58 96.36 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.044 0.538 . . . . 0.0 110.67 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -53.64 56.07 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.777 1.231 . . . . 0.0 110.544 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.1 mmm -59.28 -43.59 92.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.027 0.531 . . . . 0.0 111.233 -177.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -57.36 -49.9 74.7 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.21 -0.424 . . . . 0.0 111.21 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -70.95 -28.9 64.81 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.424 0.557 . . . . 0.0 112.414 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.72 -51.37 59.84 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.64 0.776 . . . . 0.0 110.167 175.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -58.36 -28.72 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.762 0.425 . . . . 0.0 110.545 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.53 -91.16 0.02 OUTLIER Glycine 0 CA--C 1.53 1.031 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 169.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -164.47 24.53 0.07 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.547 0.739 . . . . 0.0 112.359 -176.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 117.007 -1.473 . . . . 0.0 110.605 -178.857 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.029 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -86.88 25.06 1.36 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.594 1.157 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -174.7 130.08 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.254 2.222 . . . . 0.0 106.895 -173.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m -47.41 137.69 8.33 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.755 1.222 . . . . 0.0 110.087 -177.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -60.04 -16.7 33.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -80.62 -49.13 11.67 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.495 0.718 . . . . 0.0 111.043 170.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.5 -32.91 69.25 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.979 1.312 . . . . 0.0 111.197 173.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.0 -53.62 56.39 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 128.461 2.704 . . . . 0.0 108.204 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.5 t -53.68 -33.94 23.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.802 0.728 . . . . 0.0 111.476 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.4 t -65.94 -32.22 73.59 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.3 t -97.21 -32.68 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.646 1.578 . . . . 0.0 111.511 -174.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -87.17 -41.0 14.09 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.06 1.744 . . . . 0.0 109.179 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.31 85.02 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 119.026 -0.874 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.41 144.13 29.58 Favored 'Isoleucine or valine' 0 C--N 1.344 0.357 0 CA-C-N 118.094 0.947 . . . . 0.0 110.053 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.07 158.97 27.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.31 1.052 . . . . 0.0 113.485 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -52.19 -40.76 61.95 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.211 2.205 . . . . 0.0 110.032 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.88 -54.37 31.28 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.217 0.913 . . . . 0.0 111.142 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -59.03 -46.02 89.26 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 117.229 0.514 . . . . 0.0 110.782 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -61.67 -46.69 88.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.052 0.541 . . . . 0.0 110.405 -176.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.06 -19.32 65.81 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 178.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.12 -34.87 20.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.893 0.877 . . . . 0.0 111.22 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.1 mt -61.36 150.4 80.26 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.763 0.825 . . . . 0.0 109.907 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.0 144.86 35.23 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.329 2.686 . . . . 0.0 112.622 177.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.19 -33.02 44.67 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.882 0.753 . . . . 0.0 112.71 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.77 -50.38 57.42 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.61 0.705 . . . . 0.0 110.673 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -62.15 -33.09 73.84 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.79 -57.82 11.05 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 122.98 0.512 . . . . 0.0 110.392 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -38.56 91.63 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.55 0.34 . . . . 0.0 110.848 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.52 -54.63 38.49 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.248 1.419 . . . . 0.0 109.908 174.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -59.53 -41.7 90.6 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 118.788 -0.625 . . . . 0.0 112.268 178.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -57.33 -50.72 72.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.953 0.797 . . . . 0.0 111.019 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.72 -44.25 93.82 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.863 0.465 . . . . 0.0 112.001 176.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -67.39 -54.14 23.1 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.842 0.857 . . . . 0.0 111.539 -174.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -57.68 -28.7 64.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.605 0.762 . . . . 0.0 110.448 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.66 -91.32 0.02 OUTLIER Glycine 0 CA--C 1.531 1.063 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 169.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -166.72 26.96 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.945 0.898 . . . . 0.0 112.248 -176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.6 t80 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.822 -176.193 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.005 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.51 176.17 5.65 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.584 0.753 . . . . 0.0 111.887 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.0 mp 55.25 85.19 0.07 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 84.4 p -64.77 146.72 54.42 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -55.34 -28.38 53.4 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.571 0.748 . . . . 0.0 111.605 -173.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.93 -48.2 12.65 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.96 0.904 . . . . 0.0 112.467 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.22 -38.42 83.31 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.542 0.61 . . . . 0.0 111.51 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -49.56 -59.75 3.48 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 126.675 1.99 . . . . 0.0 107.472 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -54.23 -37.78 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.284 0.947 . . . . 0.0 112.653 177.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.7 t -64.09 -41.43 97.29 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.238 0.472 . . . . 0.0 111.453 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.4 t -83.57 -31.54 8.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.82 1.648 . . . . 0.0 111.509 -176.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.74 -38.82 19.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.863 1.265 . . . . 0.0 108.907 -170.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.04 24.04 55.94 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.2 pp -133.71 -169.83 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.06 158.21 20.62 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.609 1.164 . . . . 0.0 112.569 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -51.58 -39.49 57.97 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.365 -1.743 . . . . 0.0 110.097 170.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.31 -54.39 27.13 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.08 -45.34 87.29 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.038 0.535 . . . . 0.0 110.74 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -59.3 -46.8 87.59 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.619 0.768 . . . . 0.0 110.435 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.52 -18.65 65.48 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.42 -33.96 16.64 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.907 . . . . 0.0 111.225 175.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.07 151.2 86.83 Favored Pre-proline 0 CA--C 1.536 0.434 0 C-N-CA 123.614 0.766 . . . . 0.0 110.034 -177.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.58 144.47 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.194 2.596 . . . . 0.0 112.564 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.41 -31.92 44.1 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.001 0.81 . . . . 0.0 112.628 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -68.28 -50.39 53.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.771 0.786 . . . . 0.0 110.635 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.96 -33.14 73.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -177.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -61.03 -57.52 12.25 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 123.023 0.529 . . . . 0.0 110.319 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.56 -37.65 88.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.79 0.436 . . . . 0.0 110.926 -176.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -53.98 47.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.243 1.417 . . . . 0.0 109.543 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 62.0 mtm -62.33 -40.05 95.09 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.197 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.53 -52.25 65.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.899 0.772 . . . . 0.0 111.062 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -58.17 -47.46 83.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 175.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -66.2 -52.69 45.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.285 0.634 . . . . 0.0 111.105 -169.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -60.81 -32.2 71.57 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.309 174.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.3 -89.17 0.02 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 124.909 1.243 . . . . 0.0 111.746 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.79 42.35 0.21 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.069 1.348 . . . . 0.0 110.325 -169.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.4 t80 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 129.172 2.989 . . . . 0.0 111.006 -177.888 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.021 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -65.95 107.36 1.83 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.618 0.767 . . . . 0.0 109.582 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.8 mp 59.28 94.41 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.817 1.647 . . . . 0.0 111.805 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.4 p -58.78 147.29 33.9 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -58.49 -25.32 62.22 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -79.33 -48.54 13.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.21 0.604 . . . . 0.0 111.188 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.23 -38.61 77.19 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.407 0.683 . . . . 0.0 109.611 175.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.416 ' CE2' ' CD2' ' A' ' 11' ' ' PHE . 9.0 t80 -57.62 -61.11 2.74 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.855 2.062 . . . . 0.0 107.479 173.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -50.55 -38.13 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 120.09 1.314 . . . . 0.0 112.138 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 t -60.82 -35.09 75.63 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.7 t -99.06 -33.06 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 125.949 1.699 . . . . 0.0 111.99 -173.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.416 ' CD2' ' CE2' ' A' ' 7' ' ' PHE . 12.8 m-85 -90.83 -39.05 12.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.559 1.943 . . . . 0.0 109.355 -169.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.44 6.15 89.43 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.545 -1.141 . . . . 0.0 111.399 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.6 pt -123.6 140.86 45.87 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.343 1.071 . . . . 0.0 110.348 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.3 159.06 30.04 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.72 1.208 . . . . 0.0 113.455 -175.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -53.79 -39.74 65.7 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 126.575 1.95 . . . . 0.0 110.451 169.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.09 -54.88 32.98 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.173 0.892 . . . . 0.0 110.9 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -65.3 -40.31 93.64 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 117.468 0.634 . . . . 0.0 110.82 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -57.21 -48.96 77.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.678 0.791 . . . . 0.0 110.798 174.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.81 -19.69 65.79 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.33 -35.61 25.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.618 0.767 . . . . 0.0 111.0 174.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.96 147.39 90.07 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.73 145.23 50.38 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.725 2.283 . . . . 0.0 112.66 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.88 -33.04 35.08 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.165 0.888 . . . . 0.0 112.725 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.71 -50.63 56.51 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 117.672 0.736 . . . . 0.0 110.975 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.9 tptp -62.22 -34.2 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -61.36 -58.3 8.77 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.503 0.721 . . . . 0.0 110.183 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -38.79 91.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.37 0.668 . . . . 0.0 110.62 -175.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -59.31 -55.0 40.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.803 0.441 . . . . 0.0 109.999 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.6 mmm -56.19 -42.9 77.87 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.79 0.836 . . . . 0.0 112.4 -177.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -54.27 -55.11 31.46 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.578 0.351 . . . . 0.0 110.896 174.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -63.92 -33.64 76.17 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.776 0.83 . . . . 0.0 112.925 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.99 -48.19 72.02 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 124.19 0.996 . . . . 0.0 111.274 -175.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -58.79 -29.09 66.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.255 0.48 . . . . 0.0 111.263 170.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.88 -91.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.958 0 N-CA-C 109.754 -1.338 . . . . 0.0 109.754 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -167.35 24.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.712 0.805 . . . . 0.0 112.087 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.041 -0.981 . . . . 0.0 109.496 -172.836 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.02 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -69.5 105.02 2.49 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.49 0.716 . . . . 0.0 109.476 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.4 mp 58.96 93.03 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.563 1.545 . . . . 0.0 112.714 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.0 p -64.88 140.62 58.89 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 169.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -59.77 -19.65 51.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -169.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -79.81 -47.78 14.62 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.504 0.722 . . . . 0.0 111.3 175.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -40.22 93.34 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.687 0.795 . . . . 0.0 109.714 175.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -50.58 -62.0 1.86 Allowed 'General case' 0 C--O 1.216 -0.684 0 C-N-CA 127.727 2.411 . . . . 0.0 107.397 170.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 t -50.95 -39.16 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.577 1.081 . . . . 0.0 112.201 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -65.03 -31.34 72.52 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -101.11 -27.72 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 125.818 1.647 . . . . 0.0 111.545 -173.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -85.2 -45.62 11.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.47 1.908 . . . . 0.0 108.393 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.75 13.32 80.05 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -175.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.07 141.86 37.22 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 118.132 0.966 . . . . 0.0 109.929 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.72 161.91 27.29 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.901 1.28 . . . . 0.0 113.358 -177.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -56.36 -41.75 76.66 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.564 1.946 . . . . 0.0 108.134 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.45 -53.43 28.7 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.24 -38.78 92.51 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.515 0.326 . . . . 0.0 110.943 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.55 -48.15 80.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.941 0.496 . . . . 0.0 109.673 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.84 -19.67 65.99 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.88 -35.71 23.93 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.851 0.86 . . . . 0.0 111.123 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -61.2 151.51 75.63 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.588 0.755 . . . . 0.0 109.902 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -53.53 145.77 45.72 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.124 2.55 . . . . 0.0 112.939 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.11 -33.64 30.42 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 124.465 1.031 . . . . 0.0 112.853 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -68.44 -50.65 51.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 117.658 0.729 . . . . 0.0 111.049 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.75 -34.63 76.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -61.33 -57.51 12.02 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.253 0.621 . . . . 0.0 110.395 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -39.81 95.55 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.059 -176.355 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.27 -54.67 44.11 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.975 0.51 . . . . 0.0 110.028 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.9 mmm -54.49 -44.41 72.65 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.275 0.63 . . . . 0.0 112.153 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -56.24 -50.47 71.2 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.115 0.416 . . . . 0.0 111.779 176.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -63.05 -45.0 94.31 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 118.169 0.441 . . . . 0.0 111.973 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -68.08 -49.39 61.6 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.7 0.8 . . . . 0.0 111.399 -169.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -64.12 -29.68 70.8 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.23 0.212 . . . . 0.0 110.479 173.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.61 -89.66 0.02 OUTLIER Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.869 1.223 . . . . 0.0 111.614 169.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.87 41.23 0.28 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.296 1.438 . . . . 0.0 110.562 -169.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.4 t80 . . . . . 0 C--O 1.25 1.105 0 C-N-CA 128.633 2.773 . . . . 0.0 110.917 -177.344 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.033 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.3 p90 -86.94 24.31 1.54 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.606 1.163 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -174.21 129.81 0.37 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 106.963 -173.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 94.6 p -51.06 148.55 4.29 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.962 0.905 . . . . 0.0 110.89 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -53.75 -27.55 29.3 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.603 1.561 . . . . 0.0 112.008 -172.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -80.01 -50.02 10.98 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.985 0.914 . . . . 0.0 112.156 176.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -38.58 74.25 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.915 0.864 . . . . 0.0 111.588 173.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -51.26 -57.29 9.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 128.229 2.611 . . . . 0.0 107.761 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.8 t -53.69 -33.45 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 119.124 0.875 . . . . 0.0 112.184 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -67.81 -42.68 81.19 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.543 0.61 . . . . 0.0 111.164 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.2 t -82.13 -31.59 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 125.527 1.531 . . . . 0.0 112.229 -175.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -89.15 -40.85 12.62 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.457 1.903 . . . . 0.0 108.733 -173.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.49 10.39 83.5 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 118.997 -0.891 . . . . 0.0 111.092 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.9 pt -141.85 144.61 25.31 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 118.153 0.977 . . . . 0.0 110.149 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.12 159.75 25.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 124.852 1.261 . . . . 0.0 113.73 -175.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -53.08 -42.14 65.6 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 113.045 -1.888 . . . . 0.0 109.267 169.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.74 -54.79 28.81 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -65.71 -36.4 83.51 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 117.243 0.522 . . . . 0.0 110.957 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -63.1 -47.72 81.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.801 0.441 . . . . 0.0 110.226 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.46 -19.6 66.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 177.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.39 -36.72 24.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.681 0.793 . . . . 0.0 111.039 175.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.16 148.43 84.8 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.594 0.757 . . . . 0.0 109.621 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -52.92 145.94 38.71 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.207 2.604 . . . . 0.0 112.88 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.81 -33.66 35.68 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.301 0.953 . . . . 0.0 112.781 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -68.44 -49.73 57.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.762 0.781 . . . . 0.0 110.982 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -61.01 -36.92 80.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -59.52 -58.0 10.49 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 122.98 0.512 . . . . 0.0 110.119 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -38.2 88.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.911 0.484 . . . . 0.0 110.501 -175.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -58.43 -52.79 64.16 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 119.177 -0.439 . . . . 0.0 110.32 176.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.3 mtp -54.59 -41.06 69.47 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.293 -0.86 . . . . 0.0 112.706 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -55.55 -53.59 54.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.296 0.953 . . . . 0.0 110.669 176.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -58.82 -47.81 83.51 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.268 0.627 . . . . 0.0 111.591 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.8 -52.68 55.55 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.25 1.42 . . . . 0.0 111.129 -172.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -58.94 -28.14 65.98 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.236 0.614 . . . . 0.0 110.582 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.95 -90.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 168.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -170.55 27.76 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.538 1.135 . . . . 0.0 111.742 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 116.546 -1.692 . . . . 0.0 108.251 -173.356 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.022 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -173.81 1.97 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.71 0.804 . . . . 0.0 111.911 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.4 mp 55.08 78.22 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.908 1.283 . . . . 0.0 111.222 -175.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 67.6 m -57.45 138.03 55.52 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 169.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -58.19 -22.97 53.84 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -169.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -79.16 -48.49 14.16 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.01 0.924 . . . . 0.0 111.758 174.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.2 -38.84 77.53 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.884 0.874 . . . . 0.0 109.878 174.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -55.38 -58.08 9.19 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.964 2.106 . . . . 0.0 107.845 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 13' ' ' ILE . 3.5 t -53.17 -36.13 24.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 120.4 1.455 . . . . 0.0 111.693 177.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.2 t -65.02 -39.38 93.3 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.558 0.617 . . . . 0.0 111.646 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.7 t -84.83 -32.82 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.539 1.536 . . . . 0.0 111.81 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -93.35 -49.52 5.9 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.404 1.881 . . . . 0.0 109.75 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.29 9.56 84.84 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.304 -1.275 . . . . 0.0 111.228 -170.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.401 ' O ' HG22 ' A' ' 8' ' ' VAL . 3.2 pt -117.63 140.96 38.6 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 CA-C-N 118.814 1.307 . . . . 0.0 110.286 175.385 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.97 158.3 34.98 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.769 1.228 . . . . 0.0 113.649 -175.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -52.88 -39.96 63.09 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.496 2.318 . . . . 0.0 110.307 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.51 -52.85 48.43 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -65.02 -43.13 93.44 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 117.653 0.727 . . . . 0.0 110.737 -177.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.07 -48.32 73.66 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.021 0.529 . . . . 0.0 111.324 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.54 65.5 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.22 -34.19 23.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.798 0.839 . . . . 0.0 111.102 174.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 mt -61.61 144.59 92.57 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -53.42 145.22 46.97 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.813 2.342 . . . . 0.0 112.487 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.02 -33.49 36.93 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.989 0.804 . . . . 0.0 112.824 178.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.39 -49.44 63.85 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 117.562 0.681 . . . . 0.0 110.921 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.75 -37.98 83.64 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -59.35 -55.91 28.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.12 0.568 . . . . 0.0 110.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.08 -37.14 86.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.095 0.558 . . . . 0.0 110.391 -176.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -62.72 -51.94 65.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.415 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.4 mtp -54.72 -45.45 74.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.711 0.687 . . . . 0.0 112.735 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -51.04 -55.28 18.28 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.05 0.54 . . . . 0.0 110.242 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -66.09 -36.67 83.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.782 0.833 . . . . 0.0 112.68 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -66.77 -45.43 78.55 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.475 1.11 . . . . 0.0 110.842 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -58.91 -28.01 65.8 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.804 0.275 . . . . 0.0 110.876 171.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -68.64 -92.31 0.06 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -166.37 28.98 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 112.045 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.88 -177.816 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.013 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -88.1 -117.56 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.92 0.888 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 tp -161.15 117.53 2.22 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 103.454 -2.795 . . . . 0.0 103.454 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.9 m -53.24 139.64 28.8 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.411 1.084 . . . . 0.0 111.032 -169.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -30.31 19.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.874 1.269 . . . . 0.0 113.451 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 -84.0 -45.14 13.44 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 175.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.01 -37.29 66.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.986 0.914 . . . . 0.0 110.457 173.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.27 -58.4 7.21 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 127.338 2.255 . . . . 0.0 107.287 170.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.72 -32.89 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 119.284 0.947 . . . . 0.0 111.133 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -65.64 -48.1 73.34 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.056 0.389 . . . . 0.0 110.632 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.5 t -75.0 -32.71 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.155 1.382 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -83.06 -38.02 23.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.971 1.709 . . . . 0.0 108.409 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.66 17.04 69.13 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 pt -150.8 142.11 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.35 160.91 23.64 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -176.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -52.9 -39.7 62.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 113.624 -1.625 . . . . 0.0 109.86 169.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.26 -55.52 23.18 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -58.51 -45.22 89.2 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.745 0.418 . . . . 0.0 110.967 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -60.43 -48.16 82.98 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.779 0.832 . . . . 0.0 110.245 -178.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.86 -19.52 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.81 -34.76 22.66 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.728 0.811 . . . . 0.0 111.194 175.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.68 150.78 80.71 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.566 0.746 . . . . 0.0 109.812 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -53.31 145.82 43.18 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.082 2.521 . . . . 0.0 112.876 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.43 -33.44 32.46 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.373 0.987 . . . . 0.0 112.751 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.99 -51.02 52.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.645 0.723 . . . . 0.0 110.999 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -61.95 -34.07 75.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -61.46 -57.55 11.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.302 0.641 . . . . 0.0 110.36 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -39.46 94.17 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 122.651 0.38 . . . . 0.0 110.335 -176.07 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -59.25 -52.04 67.39 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.086 0.554 . . . . 0.0 110.341 176.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 51.7 mmm -54.99 -44.23 74.3 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.352 0.661 . . . . 0.0 112.208 178.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -56.32 -51.03 69.74 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.395 0.543 . . . . 0.0 110.885 177.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.92 -44.51 94.26 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.015 0.526 . . . . 0.0 111.924 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -67.32 -52.79 36.1 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.538 1.135 . . . . 0.0 111.002 -171.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.69 -29.73 64.91 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.605 0.762 . . . . 0.0 110.509 172.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.3 -90.05 0.02 OUTLIER Glycine 0 CA--C 1.533 1.2 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -160.16 29.28 0.17 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.853 0.861 . . . . 0.0 112.267 -176.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 36.5 t80 . . . . . 0 C--O 1.252 1.198 0 C-N-CA 124.662 1.185 . . . . 0.0 110.501 -178.75 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.007 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -154.78 -160.46 1.07 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.064 0.945 . . . . 0.0 108.846 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -163.96 127.91 2.69 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.6 1.56 . . . . 0.0 107.934 -171.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.1 m -51.22 144.67 9.1 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 125.584 1.554 . . . . 0.0 110.33 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -57.36 -20.31 28.45 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -172.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -79.9 -48.02 14.13 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.39 0.676 . . . . 0.0 111.172 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.37 80.73 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 111.714 173.177 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -53.37 -53.65 48.1 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 129.135 2.974 . . . . 0.0 107.837 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 t -54.2 -31.97 22.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.162 0.892 . . . . 0.0 111.955 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.1 t -67.45 -43.9 79.97 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.321 0.51 . . . . 0.0 110.969 176.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.48 -32.95 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.85 1.66 . . . . 0.0 112.389 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -88.48 -41.26 12.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.768 2.027 . . . . 0.0 108.888 -172.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.55 11.5 81.78 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 119.085 -0.842 . . . . 0.0 111.104 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.6 pt -142.64 142.55 26.59 Favored 'Isoleucine or valine' 0 C--N 1.343 0.308 0 CA-C-N 117.945 0.873 . . . . 0.0 109.78 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.38 158.93 22.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.321 1.049 . . . . 0.0 113.58 -175.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -54.33 -41.68 69.33 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 126.201 1.8 . . . . 0.0 110.164 169.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.14 -53.74 31.57 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 177.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -63.29 -39.57 94.95 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 117.264 0.532 . . . . 0.0 110.967 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -63.02 -48.18 79.9 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.334 0.654 . . . . 0.0 109.837 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.17 -19.53 66.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.44 0.534 . . . . 0.0 112.44 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.53 -35.7 22.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.787 0.835 . . . . 0.0 111.228 175.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.2 mt -61.07 150.37 78.92 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.618 0.767 . . . . 0.0 109.774 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.03 145.44 41.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.221 2.614 . . . . 0.0 112.803 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.52 -33.3 32.9 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.275 0.94 . . . . 0.0 112.804 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -67.64 -51.19 52.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.716 0.758 . . . . 0.0 110.97 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -62.01 -34.03 75.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -61.5 -58.6 7.5 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.024 0.529 . . . . 0.0 110.05 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -38.69 90.19 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.985 0.514 . . . . 0.0 110.465 -175.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -51.07 71.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.88 0.472 . . . . 0.0 110.202 175.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mmm -57.13 -39.15 74.59 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.927 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -57.62 -53.58 56.61 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.18 0.9 . . . . 0.0 110.505 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -56.95 -46.06 82.36 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.586 0.754 . . . . 0.0 111.692 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -68.41 -50.99 48.89 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.516 1.126 . . . . 0.0 110.905 -171.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -28.91 68.24 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.936 0.494 . . . . 0.0 110.275 173.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.09 -89.88 0.02 OUTLIER Glycine 0 CA--C 1.531 1.052 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 168.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -160.63 29.12 0.16 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.739 0.816 . . . . 0.0 112.158 -176.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 22.5 t80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.646 -177.642 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.009 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -146.46 23.72 1.28 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.742 1.217 . . . . 0.0 110.92 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -175.06 130.34 0.3 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.201 2.2 . . . . 0.0 106.734 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.7 p -50.66 141.4 12.81 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.802 0.841 . . . . 0.0 110.207 -176.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -55.22 -19.57 8.48 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.054 1.342 . . . . 0.0 113.668 -169.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -81.85 -48.12 11.96 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.124 0.57 . . . . 0.0 111.501 172.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.26 72.01 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.249 1.019 . . . . 0.0 111.457 172.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.51 -58.86 4.79 Favored 'General case' 0 CA--C 1.505 -0.759 0 C-N-CA 127.557 2.343 . . . . 0.0 107.785 173.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.5 t -59.24 -32.12 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 118.761 0.71 . . . . 0.0 111.2 -177.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.8 t -66.47 -46.29 76.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.031 0.378 . . . . 0.0 110.558 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.5 t -77.29 -32.44 18.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.297 1.439 . . . . 0.0 111.981 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -84.81 -39.39 18.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.929 1.692 . . . . 0.0 108.449 -173.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.22 16.89 70.62 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.2 pt -148.9 142.83 18.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.7 158.35 24.87 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -52.77 -41.56 64.18 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.226 1.81 . . . . 0.0 110.021 169.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.67 -54.12 30.71 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.13 -36.33 83.93 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 117.451 0.625 . . . . 0.0 110.974 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -61.67 -47.36 85.7 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.156 0.583 . . . . 0.0 109.974 177.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.79 -19.12 65.77 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.23 -36.23 22.89 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.731 0.812 . . . . 0.0 111.083 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 mt -61.31 153.1 70.13 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 123.893 0.877 . . . . 0.0 109.797 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.19 150.8 87.14 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.616 2.211 . . . . 0.0 111.195 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.42 -34.12 25.96 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.915 1.245 . . . . 0.0 112.808 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -68.53 -51.16 45.99 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.712 0.756 . . . . 0.0 110.751 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -62.31 -32.49 73.25 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -61.5 -57.22 13.01 Favored 'General case' 0 C--N 1.342 0.248 0 C-N-CA 123.308 0.643 . . . . 0.0 110.664 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.17 -38.56 91.51 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 122.701 0.401 . . . . 0.0 110.663 -176.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -56.87 -51.86 67.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.865 1.266 . . . . 0.0 109.958 176.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.9 mmm -59.32 -46.81 87.56 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.338 0.655 . . . . 0.0 111.627 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -54.58 -49.62 69.94 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.5 0.591 . . . . 0.0 111.349 177.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.3 mtmt -60.96 -47.37 86.76 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.849 0.295 . . . . 0.0 111.462 176.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -64.24 -54.86 26.77 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.589 0.755 . . . . 0.0 111.473 -172.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -58.1 -29.24 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 110.444 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.44 -89.62 0.02 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.893 1.235 . . . . 0.0 110.201 169.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -158.42 28.1 0.24 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.805 0.842 . . . . 0.0 112.627 -173.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.036 178.912 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.032 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -67.58 110.79 3.83 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.254 0.622 . . . . 0.0 109.601 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.9 mp 54.64 82.11 0.1 Allowed 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.545 1.538 . . . . 0.0 112.5 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.6 m -62.22 137.73 58.3 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 168.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.87 -24.89 39.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.623 0.769 . . . . 0.0 112.619 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -81.35 -48.23 12.23 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.816 0.847 . . . . 0.0 111.848 175.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.28 -39.03 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.87 0.868 . . . . 0.0 111.597 174.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -49.82 -56.02 11.99 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 127.298 2.239 . . . . 0.0 107.75 171.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.07 -30.73 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 119.197 0.908 . . . . 0.0 111.214 -177.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.81 -48.64 68.33 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.429 0.559 . . . . 0.0 110.232 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.1 t -73.42 -32.15 35.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 125.302 1.441 . . . . 0.0 112.023 -177.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -86.44 -23.25 26.11 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.169 1.787 . . . . 0.0 109.61 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.35 28.18 19.17 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 124.694 1.14 . . . . 0.0 112.82 -172.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 19.9 pt -145.29 143.74 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 172.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.24 158.88 27.76 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.903 0.858 . . . . 0.0 113.274 -176.554 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -54.67 -40.45 69.09 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.944 1.697 . . . . 0.0 109.9 170.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.6 -54.39 29.2 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.141 0.877 . . . . 0.0 110.92 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -64.35 -38.18 90.13 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 117.353 0.577 . . . . 0.0 110.859 -178.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.11 -49.66 77.02 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.611 0.764 . . . . 0.0 109.941 176.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.2 65.75 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.73 -34.07 21.31 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.93 0.892 . . . . 0.0 111.414 175.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -61.63 154.04 67.69 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.679 0.792 . . . . 0.0 110.452 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.09 144.77 36.33 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.312 2.674 . . . . 0.0 112.619 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.66 -32.78 40.34 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.014 0.816 . . . . 0.0 112.595 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -68.1 -51.47 46.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.718 0.759 . . . . 0.0 110.808 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -61.58 -32.99 73.12 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -61.78 -58.73 6.87 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.127 0.571 . . . . 0.0 110.508 176.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -37.49 86.01 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 122.721 0.408 . . . . 0.0 111.072 -176.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -54.43 47.09 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.957 1.303 . . . . 0.0 109.984 175.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.3 mmm -56.78 -43.39 80.82 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 119.159 -0.448 . . . . 0.0 111.559 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -59.7 -48.36 81.98 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 118.929 -0.558 . . . . 0.0 111.865 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.52 70.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.844 0.747 . . . . 0.0 111.722 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.94 -63.24 1.17 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 109.682 -177.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -56.39 -30.02 62.22 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.083 0.553 . . . . 0.0 110.463 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -54.04 -87.62 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.741 1.638 . . . . 0.0 111.788 169.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.86 39.45 3.65 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.656 1.182 . . . . 0.0 113.424 -168.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 47.4 t80 . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.882 -1.056 . . . . 0.0 109.665 173.343 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.94 162.57 21.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.51 0.724 . . . . 0.0 111.532 . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.2 mp 54.2 83.8 0.07 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.76 1.224 . . . . 0.0 112.641 174.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.1 m -63.6 133.65 54.1 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 169.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -55.53 -23.67 27.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.77 0.828 . . . . 0.0 113.118 -169.756 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -78.64 -47.45 17.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.76 0.824 . . . . 0.0 111.561 175.296 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.59 -41.09 89.47 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.217 1.008 . . . . 0.0 111.1 174.203 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.9 -52.25 61.13 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.328 3.051 . . . . 0.0 108.293 174.413 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -52.97 -30.99 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 119.884 1.22 . . . . 0.0 112.045 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.1 t -68.85 -46.65 67.94 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.825 0.739 . . . . 0.0 110.865 176.668 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 85.8 t -78.08 -28.61 15.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.762 1.625 . . . . 0.0 112.468 -174.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -94.31 -30.03 14.74 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 126.908 2.083 . . . . 0.0 110.146 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 50.52 26.87 10.72 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.98 0.8 . . . . 0.0 112.927 -169.704 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.12 141.31 41.93 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 CA-C-N 117.84 0.82 . . . . 0.0 109.372 169.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.39 161.32 29.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 125.007 1.323 . . . . 0.0 113.408 -176.769 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -54.22 -41.21 68.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.875 1.67 . . . . 0.0 109.762 169.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.75 -54.33 26.02 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 110.714 -0.955 . . . . 0.0 110.714 -179.779 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.44 -38.84 92.71 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.833 0.453 . . . . 0.0 111.058 -179.169 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.74 -47.73 82.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.29 0.636 . . . . 0.0 109.795 177.815 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.33 -19.54 66.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.74 -35.64 24.25 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.803 0.841 . . . . 0.0 110.977 175.436 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 mt -60.7 152.05 69.37 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.597 0.759 . . . . 0.0 109.682 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.78 144.22 44.64 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.977 2.451 . . . . 0.0 112.41 177.069 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -31.64 47.12 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 123.864 0.745 . . . . 0.0 112.509 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.0 p-90 -68.08 -50.98 51.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.668 0.734 . . . . 0.0 110.601 174.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 tptp -62.49 -31.78 72.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -176.801 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -62.2 -57.98 9.46 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.324 0.65 . . . . 0.0 110.58 176.155 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.58 84.53 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.886 0.475 . . . . 0.0 110.551 -176.216 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -58.47 -53.08 62.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.696 1.198 . . . . 0.0 109.646 175.294 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.8 mmm -58.78 -45.34 90.06 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.945 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -53.34 -52.47 59.11 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.456 0.571 . . . . 0.0 111.134 174.741 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -60.39 -43.09 96.96 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.584 0.754 . . . . 0.0 111.611 178.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.64 -53.15 16.97 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.053 0.941 . . . . 0.0 110.868 -171.907 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -59.41 -28.55 67.02 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.552 0.341 . . . . 0.0 110.382 172.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.68 -90.37 0.02 OUTLIER Glycine 0 CA--C 1.53 1.021 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 168.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -163.19 24.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.335 0.654 . . . . 0.0 112.645 -176.478 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.8 t80 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 117.547 -1.216 . . . . 0.0 110.016 -176.762 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.032 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -81.53 38.83 0.51 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.969 1.307 . . . . 0.0 111.576 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -173.95 130.87 0.4 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.095 2.158 . . . . 0.0 106.551 -176.602 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.2 m -43.12 137.04 2.65 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.066 1.346 . . . . 0.0 110.3 -175.811 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -57.51 -20.68 33.07 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -169.279 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -84.83 -46.01 11.76 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.677 0.672 . . . . 0.0 112.532 171.451 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.85 -37.26 63.46 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.375 1.07 . . . . 0.0 110.712 172.292 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -52.43 -58.7 5.89 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 127.216 2.207 . . . . 0.0 107.881 170.299 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -59.16 -31.99 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 118.778 0.717 . . . . 0.0 110.939 -176.81 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -65.28 -49.03 71.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.023 0.374 . . . . 0.0 110.455 177.439 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.3 t -75.16 -33.48 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.449 1.1 . . . . 0.0 111.868 -177.069 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -80.86 -34.71 33.54 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.054 1.742 . . . . 0.0 108.819 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.49 16.0 74.71 Favored Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 177.583 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.7 pt -151.31 144.9 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 -175.425 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.28 158.32 29.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.0 0.905 . . . . 0.0 113.235 -177.591 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.8 ttt180 -53.83 -39.6 65.7 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.281 1.832 . . . . 0.0 110.086 170.42 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.93 -54.84 27.99 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.07 0.843 . . . . 0.0 111.042 177.176 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.01 -36.56 84.77 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 117.437 0.619 . . . . 0.0 110.954 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -59.76 -48.86 79.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.817 0.847 . . . . 0.0 109.994 175.056 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.15 -19.38 65.95 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 178.459 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.64 -34.95 22.97 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.836 0.854 . . . . 0.0 111.353 175.193 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.04 152.89 58.81 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.57 0.748 . . . . 0.0 110.275 179.249 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.13 144.49 37.7 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.24 2.627 . . . . 0.0 112.514 177.552 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.17 -32.13 42.77 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 123.988 0.804 . . . . 0.0 112.496 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -68.29 -50.69 51.93 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.685 0.743 . . . . 0.0 110.734 175.157 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -61.94 -32.96 73.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.782 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -61.11 -57.69 11.47 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.883 0.473 . . . . 0.0 110.599 176.712 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -38.58 91.69 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.519 0.328 . . . . 0.0 110.684 -177.149 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -52.33 63.87 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.303 1.441 . . . . 0.0 109.691 175.965 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.2 mmm -58.7 -49.09 78.86 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.511 0.596 . . . . 0.0 111.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -57.4 -47.24 82.24 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.569 0.348 . . . . 0.0 111.268 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtmt -62.35 -44.71 95.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.852 0.461 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.43 -42.7 96.61 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.734 1.213 . . . . 0.0 111.588 -172.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -57.26 -30.68 64.87 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.457 0.303 . . . . 0.0 111.023 174.546 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.55 -91.59 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 169.539 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.52 35.02 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.719 1.208 . . . . 0.0 110.543 -175.199 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.7 t80 . . . . . 0 C--O 1.251 1.161 0 C-N-CA 125.832 1.653 . . . . 0.0 110.013 -169.536 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.023 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -73.54 94.72 2.17 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.438 0.695 . . . . 0.0 109.739 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.61 108.07 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.34 1.856 . . . . 0.0 113.573 169.264 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.0 p -67.28 142.38 56.89 Favored 'General case' 0 C--N 1.342 0.241 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 169.071 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -56.95 -26.47 59.68 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.984 0.914 . . . . 0.0 111.987 -170.207 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -78.73 -48.05 15.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.53 0.732 . . . . 0.0 111.763 177.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.18 -39.39 86.34 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.476 0.58 . . . . 0.0 111.63 174.304 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -51.52 -61.41 2.26 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 127.171 2.188 . . . . 0.0 107.367 170.958 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -53.14 -38.86 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.048 0.84 . . . . 0.0 112.342 178.721 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.9 t -62.05 -39.78 93.53 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 117.918 0.326 . . . . 0.0 111.463 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -89.32 -30.46 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.479 1.512 . . . . 0.0 111.823 -175.132 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.77 -39.37 18.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.095 1.358 . . . . 0.0 108.815 -169.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.13 23.63 56.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.072 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -130.39 -165.6 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 172.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.03 159.17 25.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 124.939 1.296 . . . . 0.0 112.499 170.755 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -50.46 -41.17 52.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.162 2.185 . . . . 0.0 110.239 169.877 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.26 -53.83 30.63 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 179.149 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -59.81 -45.46 92.28 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.025 0.53 . . . . 0.0 110.758 178.792 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -61.41 -44.91 96.33 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.326 0.65 . . . . 0.0 110.139 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -18.44 65.33 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 178.638 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -33.83 15.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.059 0.944 . . . . 0.0 111.311 176.765 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -62.5 152.73 79.67 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.691 0.797 . . . . 0.0 110.668 -176.237 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -52.54 144.62 40.84 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.355 2.703 . . . . 0.0 112.544 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.34 -32.94 45.51 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.982 0.801 . . . . 0.0 112.638 178.042 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -68.67 -49.18 61.11 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.774 0.787 . . . . 0.0 110.718 175.26 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -61.92 -32.87 73.31 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -62.52 -58.06 8.92 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.198 0.599 . . . . 0.0 110.344 176.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 -35.79 81.79 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.798 0.439 . . . . 0.0 110.978 -177.085 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -56.27 -55.39 33.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.875 1.67 . . . . 0.0 110.096 175.336 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.6 mmm -56.24 -46.48 79.55 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.777 0.431 . . . . 0.0 110.915 177.468 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -56.7 -50.03 73.37 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 178.163 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -71.12 -30.97 67.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.65 0.659 . . . . 0.0 111.287 -177.108 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -72.96 -57.39 4.08 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.164 0.585 . . . . 0.0 110.898 -177.694 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -59.09 -31.22 68.71 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.02 0.528 . . . . 0.0 110.079 174.393 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.92 -88.54 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 125.218 1.389 . . . . 0.0 111.073 169.318 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.42 43.1 0.59 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.504 1.122 . . . . 0.0 111.144 -169.939 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.3 t80 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 127.671 2.389 . . . . 0.0 111.107 -177.916 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -82.93 35.9 0.49 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.912 1.285 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -176.15 130.71 0.23 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.391 2.276 . . . . 0.0 106.661 -177.256 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.9 p -47.67 149.45 1.23 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 123.883 0.873 . . . . 0.0 111.164 -176.067 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -57.05 -23.61 47.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.874 0.47 . . . . 0.0 112.08 -175.323 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -84.83 -46.76 11.04 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 173.461 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.09 -37.97 67.51 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.408 0.623 . . . . 0.0 110.085 174.498 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -49.93 -59.65 3.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 127.549 2.34 . . . . 0.0 107.958 169.927 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.2 t -58.76 -32.76 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 119.101 0.864 . . . . 0.0 110.881 -177.388 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.3 t -65.25 -45.43 84.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.016 0.371 . . . . 0.0 110.822 178.628 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.3 t -80.3 -33.37 14.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.376 1.07 . . . . 0.0 111.718 -176.954 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -79.83 -35.2 38.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.988 1.715 . . . . 0.0 108.634 -175.736 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.33 15.89 75.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 177.711 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.0 pt -150.28 144.01 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.165 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.95 158.43 30.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 122.102 0.953 . . . . 0.0 113.237 -176.731 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -52.54 -39.86 61.89 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 126.456 1.902 . . . . 0.0 110.217 169.967 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.03 -55.3 25.01 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.139 0.876 . . . . 0.0 111.05 177.597 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.14 -35.68 81.86 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 117.357 0.578 . . . . 0.0 111.042 -178.246 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -60.7 -48.38 82.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.648 0.779 . . . . 0.0 110.005 175.298 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.24 65.84 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.224 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.4 -35.13 23.33 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.834 0.854 . . . . 0.0 111.211 175.117 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.25 152.92 60.93 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 123.54 0.736 . . . . 0.0 110.339 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.61 144.51 41.9 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.225 2.617 . . . . 0.0 112.578 177.722 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.86 -32.68 41.6 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.057 0.837 . . . . 0.0 112.591 177.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -68.26 -50.39 54.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.634 0.717 . . . . 0.0 110.779 175.32 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -62.07 -33.0 73.6 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.17 -57.44 12.46 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.04 0.536 . . . . 0.0 110.71 176.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -39.4 94.22 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.545 0.338 . . . . 0.0 110.651 -177.219 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -54.35 -53.35 55.08 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.217 1.407 . . . . 0.0 109.489 175.634 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 45.8 mmm -58.41 -47.48 83.79 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 111.58 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -55.61 -49.62 72.33 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.392 0.277 . . . . 0.0 111.404 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -64.06 -42.64 96.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 178.15 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -57.29 -42.26 81.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.002 1.321 . . . . 0.0 112.271 -173.358 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -59.24 -32.32 69.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.049 0.386 . . . . 0.0 110.775 175.757 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.41 -90.2 0.1 Allowed Glycine 0 CA--C 1.529 0.91 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 169.565 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -156.53 24.11 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.457 1.103 . . . . 0.0 111.335 -177.223 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.673 1.589 . . . . 0.0 110.885 -169.959 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.01 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 37.1 p90 -148.39 23.8 1.02 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.679 1.192 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -170.29 129.66 0.89 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.544 1.538 . . . . 0.0 108.368 -174.312 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 m -39.56 139.69 0.56 Allowed 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 126.604 1.962 . . . . 0.0 111.629 178.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -43.03 -36.04 1.46 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.178 1.391 . . . . 0.0 113.331 -178.454 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -79.46 -44.36 21.47 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.176 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -58.84 -34.46 71.58 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.038 0.935 . . . . 0.0 110.464 173.679 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -57.92 -58.93 6.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.637 1.975 . . . . 0.0 107.205 171.53 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.99 -38.13 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 119.46 1.027 . . . . 0.0 111.965 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.2 t -61.37 -45.62 93.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.909 0.322 . . . . 0.0 111.197 178.863 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.79 -34.11 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.934 1.294 . . . . 0.0 111.984 -175.239 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -85.14 -36.25 21.2 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.524 1.53 . . . . 0.0 109.01 -170.622 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.83 7.4 88.04 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 178.494 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.0 pt -139.21 146.99 24.95 Favored 'Isoleucine or valine' 0 C--N 1.341 0.233 0 CA-C-N 117.786 0.793 . . . . 0.0 110.162 -177.725 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -62.54 156.91 21.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 122.174 0.988 . . . . 0.0 113.02 -177.286 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.8 ttp180 -57.39 -39.05 75.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.22 -1.809 . . . . 0.0 108.805 172.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.44 -53.18 33.8 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.352 0.977 . . . . 0.0 111.105 177.716 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -64.91 -36.66 85.1 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 117.815 0.807 . . . . 0.0 110.779 -178.031 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -60.91 -48.33 82.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.788 0.435 . . . . 0.0 110.608 176.092 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.38 65.85 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 178.026 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.62 -35.79 22.46 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.801 0.84 . . . . 0.0 111.142 175.069 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.24 150.45 79.48 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.568 0.747 . . . . 0.0 109.858 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.14 144.46 37.88 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.164 2.576 . . . . 0.0 112.493 176.909 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.69 -32.0 46.38 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.912 0.768 . . . . 0.0 112.608 178.122 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -67.57 -50.61 57.59 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.78 0.79 . . . . 0.0 110.612 174.463 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.04 -32.25 72.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.656 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.75 -57.54 11.51 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 122.83 0.452 . . . . 0.0 110.481 176.487 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -37.18 86.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.705 0.402 . . . . 0.0 110.873 -176.524 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -53.53 55.94 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.315 1.446 . . . . 0.0 109.451 173.979 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.9 mmm -57.66 -42.63 83.93 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.525 0.602 . . . . 0.0 111.334 178.699 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -57.57 -52.03 67.08 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.708 177.488 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.36 -35.32 77.56 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.313 0.506 . . . . 0.0 111.514 -176.934 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -71.5 -59.1 2.94 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -175.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -58.08 -33.26 68.88 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 122.814 0.446 . . . . 0.0 110.625 176.304 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -50.84 -88.12 0.01 OUTLIER Glycine 0 CA--C 1.529 0.923 0 C-N-CA 126.23 1.871 . . . . 0.0 111.3 169.038 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.44 40.64 0.21 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.192 0.597 . . . . 0.0 111.724 -169.774 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.618 -1.182 . . . . 0.0 110.5 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.69 -37.32 75.79 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.304 1.042 . . . . 0.0 110.285 175.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -54.38 -60.87 2.76 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 127.51 2.324 . . . . 0.0 107.427 171.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.4 t -51.62 -38.92 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.33 0.968 . . . . 0.0 112.513 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -62.68 -41.72 99.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.186 0.448 . . . . 0.0 111.524 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.2 t -84.53 -31.82 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.465 1.506 . . . . 0.0 112.124 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -87.23 -31.81 20.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.894 1.678 . . . . 0.0 109.717 -170.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.0 20.76 64.48 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -132.59 -168.07 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.48 157.02 23.5 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 124.948 1.299 . . . . 0.0 112.253 169.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -54.27 -38.97 66.44 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.009 172.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.58 -54.83 20.59 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -62.55 -37.6 86.76 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.075 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -62.5 -47.81 82.33 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.545 0.738 . . . . 0.0 110.131 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -19.22 65.78 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.24 -35.55 21.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.893 0.877 . . . . 0.0 111.191 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -60.6 151.71 69.82 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 123.513 0.725 . . . . 0.0 110.138 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.24 144.46 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.223 2.615 . . . . 0.0 112.524 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.92 -31.78 47.75 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.848 0.737 . . . . 0.0 112.565 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.9 p-90 -67.87 -49.95 59.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 117.747 0.773 . . . . 0.0 110.768 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.63 -34.37 75.55 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -60.2 -57.7 11.7 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 122.708 0.403 . . . . 0.0 110.527 177.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -36.69 84.86 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.878 0.471 . . . . 0.0 110.928 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -53.92 49.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 174.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 83.0 mtp -59.36 -46.01 89.82 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.876 0.762 . . . . 0.0 112.243 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -52.73 -53.13 52.09 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.037 0.38 . . . . 0.0 110.558 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -66.15 -37.76 86.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.759 0.824 . . . . 0.0 112.648 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 . . . . . 0 CA--C 1.527 0.089 0 C-N-CA 124.426 1.09 . . . . 0.0 111.534 -176.833 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.03 -32.67 71.12 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.436 0.694 . . . . 0.0 110.157 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -51.99 -56.64 13.0 Favored 'General case' 0 C--O 1.215 -0.717 0 C-N-CA 127.629 2.372 . . . . 0.0 108.13 171.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -54.97 -30.34 23.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 119.156 0.889 . . . . 0.0 111.687 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -68.25 -47.52 67.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.625 0.648 . . . . 0.0 110.898 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.2 t -77.28 -32.74 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.081 1.353 . . . . 0.0 112.138 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -87.53 -42.69 12.57 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.382 1.873 . . . . 0.0 108.614 -172.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.61 7.87 87.62 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.812 -0.994 . . . . 0.0 110.861 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.4 pt -137.1 142.33 37.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.302 1.051 . . . . 0.0 110.857 -176.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.26 162.56 28.24 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 126.346 1.859 . . . . 0.0 114.624 -175.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -44.89 54.66 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.536 2.334 . . . . 0.0 109.301 169.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.53 -54.81 31.27 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -67.98 -34.71 77.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.998 0.399 . . . . 0.0 111.527 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.96 -45.94 79.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -19.46 65.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.87 -36.99 24.94 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.591 0.756 . . . . 0.0 110.85 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.62 148.67 81.01 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 123.368 0.667 . . . . 0.0 109.888 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.34 146.38 32.46 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.356 2.704 . . . . 0.0 112.939 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -33.54 49.99 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.051 0.834 . . . . 0.0 112.682 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -65.05 -52.87 53.36 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 117.91 0.855 . . . . 0.0 110.06 173.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -62.46 -32.26 73.11 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 -174.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -61.93 -58.12 9.14 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 122.955 0.502 . . . . 0.0 110.962 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -36.39 81.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.86 0.464 . . . . 0.0 110.273 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.16 -51.62 60.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.853 1.661 . . . . 0.0 110.978 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mtp -49.96 -49.63 49.55 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.036 0.834 . . . . 0.0 111.475 175.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.8 mtpt -53.82 -48.09 70.25 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.142 0.428 . . . . 0.0 111.423 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.07 -44.76 95.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.819 0.448 . . . . 0.0 111.931 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 . . . . . 0 CA--C 1.529 0.155 0 C-N-CA 123.879 0.871 . . . . 0.0 110.734 -169.961 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.12 -36.42 72.89 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.463 0.705 . . . . 0.0 110.169 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.873 ' CZ ' ' CD2' ' A' ' 11' ' ' PHE . 3.3 t80 -51.43 -57.79 8.02 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 127.642 2.377 . . . . 0.0 107.455 172.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 t -59.27 -31.59 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-N 119.1 0.864 . . . . 0.0 111.217 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.88 -48.56 68.4 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.141 0.428 . . . . 0.0 110.52 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.8 -32.96 36.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.331 1.452 . . . . 0.0 112.072 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.873 ' CD2' ' CZ ' ' A' ' 7' ' ' PHE . 7.1 m-85 -83.65 -38.74 21.13 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 125.935 1.694 . . . . 0.0 108.296 -174.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.25 17.72 68.55 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.4 pt -150.06 143.37 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.93 158.97 26.68 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.3 ttt180 -52.54 -41.88 63.9 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.793 2.037 . . . . 0.0 110.094 169.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.31 29.09 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -65.16 -36.49 84.4 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.292 0.546 . . . . 0.0 111.085 -177.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -62.15 -48.5 79.81 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.058 0.543 . . . . 0.0 109.691 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.27 65.84 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.52 -35.57 22.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.895 0.878 . . . . 0.0 111.297 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.26 151.96 74.24 Favored Pre-proline 0 CA--C 1.536 0.419 0 C-N-CA 123.549 0.74 . . . . 0.0 110.202 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.47 146.11 43.55 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.202 2.601 . . . . 0.0 112.864 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.29 -33.93 32.26 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.439 1.018 . . . . 0.0 112.749 177.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.68 -51.44 49.59 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 117.766 0.783 . . . . 0.0 110.979 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -61.91 -33.82 74.94 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -61.92 -57.61 11.08 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.239 0.616 . . . . 0.0 110.343 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -39.26 93.48 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.7 0.4 . . . . 0.0 110.411 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -59.17 -52.9 63.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.007 0.523 . . . . 0.0 110.179 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 53.7 mmm -55.25 -44.08 75.2 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.371 0.668 . . . . 0.0 112.313 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -56.07 -51.67 67.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.374 0.533 . . . . 0.0 111.087 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -60.3 -45.35 93.66 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.858 0.463 . . . . 0.0 111.628 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 . . . . . 0 N--CA 1.456 -0.158 0 C-N-CA 124.347 1.059 . . . . 0.0 110.843 -173.061 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.76 -39.91 62.65 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.555 1.142 . . . . 0.0 111.758 172.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -52.35 -58.23 7.34 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 128.068 2.547 . . . . 0.0 107.884 174.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.28 -32.14 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 118.674 0.67 . . . . 0.0 110.998 -176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -66.28 -45.02 81.9 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.102 0.41 . . . . 0.0 110.673 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.7 t -77.79 -33.45 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.235 1.414 . . . . 0.0 111.99 -177.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -84.42 -38.57 20.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.784 1.633 . . . . 0.0 108.647 -173.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.39 16.95 70.05 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.9 pt -149.58 142.61 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.13 158.78 25.0 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -53.54 -41.01 65.98 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 126.19 1.796 . . . . 0.0 110.07 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.07 -53.62 29.0 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.84 -38.33 90.35 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.116 0.458 . . . . 0.0 111.012 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -62.31 -47.22 85.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.405 0.682 . . . . 0.0 109.875 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -19.33 65.87 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.59 -35.75 22.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.756 0.822 . . . . 0.0 111.153 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.94 153.04 67.68 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 123.852 0.861 . . . . 0.0 109.967 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.55 150.31 86.75 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.627 2.218 . . . . 0.0 111.252 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.37 -34.54 26.42 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.938 1.256 . . . . 0.0 112.853 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.7 p-90 -69.03 -49.66 55.63 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.747 0.773 . . . . 0.0 111.115 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -61.62 -35.4 77.77 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -60.68 -58.16 9.64 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 122.819 0.448 . . . . 0.0 110.202 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -39.39 92.97 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.793 0.437 . . . . 0.0 110.592 -176.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -56.34 -53.84 52.56 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.947 0.499 . . . . 0.0 109.836 175.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.7 mmm -56.84 -41.45 77.9 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.713 0.805 . . . . 0.0 112.246 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.26 -53.18 60.29 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.866 0.757 . . . . 0.0 110.838 175.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -59.76 -45.06 93.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.193 0.597 . . . . 0.0 111.49 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 . . . . . 0 CA--C 1.529 0.159 0 C-N-CA 124.601 1.16 . . . . 0.0 110.617 -172.054 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 . . . . . 0 CA--C 1.538 0.503 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.8 -33.62 66.86 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.748 1.219 . . . . 0.0 110.921 174.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -54.76 -57.1 12.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 127.375 2.27 . . . . 0.0 107.77 172.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -60.05 -33.13 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 118.807 0.731 . . . . 0.0 110.737 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 t -63.44 -48.65 76.85 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.012 0.369 . . . . 0.0 110.438 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 75.4 t -75.77 -32.94 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.584 1.154 . . . . 0.0 111.87 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.93 -24.72 28.26 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.993 1.717 . . . . 0.0 109.713 -173.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.38 28.51 20.49 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.645 1.117 . . . . 0.0 112.777 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.5 pt -144.91 141.75 23.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -66.5 159.39 27.33 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -176.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -53.95 -42.05 68.44 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 126.491 1.916 . . . . 0.0 110.19 169.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.26 -52.9 32.53 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -62.66 -40.47 97.15 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 116.972 0.386 . . . . 0.0 110.925 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.82 -49.34 78.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.353 0.661 . . . . 0.0 109.588 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -18.93 65.32 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.05 -33.86 19.38 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.006 0.922 . . . . 0.0 111.426 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.03 154.36 69.34 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 123.801 0.841 . . . . 0.0 110.571 -177.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.22 145.75 33.85 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.291 2.661 . . . . 0.0 112.653 176.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.61 -33.82 42.11 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.063 0.839 . . . . 0.0 112.658 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -67.25 -51.39 53.69 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 117.724 0.762 . . . . 0.0 110.679 175.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.02 -32.83 73.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.4 -58.85 6.54 Favored 'General case' 0 C--N 1.34 0.168 0 O-C-N 121.952 -0.467 . . . . 0.0 110.545 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.15 -38.52 89.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.661 0.384 . . . . 0.0 110.608 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -57.62 -55.63 32.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.606 1.563 . . . . 0.0 110.5 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 73.8 mmm -56.88 -44.16 81.99 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.63 0.65 . . . . 0.0 111.913 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -56.41 -52.07 66.01 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.371 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.08 -43.37 92.38 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.045 0.384 . . . . 0.0 111.443 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 . . . . . 0 N--CA 1.453 -0.286 0 C-N-CA 123.245 0.618 . . . . 0.0 111.035 -169.392 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 . . . . . 0 CA--C 1.539 0.543 0 N-CA-C 111.377 0.14 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.58 -37.74 65.89 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.035 1.334 . . . . 0.0 110.988 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -52.33 -57.47 9.67 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 127.407 2.283 . . . . 0.0 108.131 172.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -61.12 -31.58 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 118.359 0.527 . . . . 0.0 110.705 -176.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.0 t -64.99 -44.85 87.95 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.963 0.347 . . . . 0.0 110.658 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.1 t -79.84 -34.95 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.475 1.11 . . . . 0.0 111.786 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -79.8 -32.72 40.79 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.823 1.649 . . . . 0.0 108.775 -175.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.79 15.31 75.74 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 pt -151.86 146.57 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -175.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.22 158.2 29.47 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -53.41 -39.86 64.66 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.102 -1.863 . . . . 0.0 109.87 170.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.4 -54.28 30.48 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.177 0.894 . . . . 0.0 111.08 177.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.89 -36.15 83.43 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 117.511 0.656 . . . . 0.0 110.972 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.48 -48.64 80.88 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.421 0.689 . . . . 0.0 110.146 175.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.81 -19.29 65.77 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.83 -34.99 22.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.855 0.862 . . . . 0.0 111.351 175.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.32 153.03 61.09 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.59 0.756 . . . . 0.0 110.373 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.72 144.76 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.227 2.618 . . . . 0.0 112.735 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.54 -32.84 39.59 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.088 0.851 . . . . 0.0 112.62 177.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -68.18 -50.59 53.34 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 117.766 0.783 . . . . 0.0 110.844 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.9 -35.07 75.71 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.16 -57.95 10.61 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.695 0.398 . . . . 0.0 110.576 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -37.22 86.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.896 0.478 . . . . 0.0 110.654 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.13 -54.58 45.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.113 1.365 . . . . 0.0 110.284 177.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.0 mtp -55.61 -45.52 77.5 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 118.16 0.436 . . . . 0.0 111.603 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.36 -49.14 78.28 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 119.274 -0.394 . . . . 0.0 111.625 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -70.62 -29.24 65.57 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.538 0.608 . . . . 0.0 111.974 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 . . . . . 0 C--N 1.34 0.179 0 C-N-CA 123.937 0.895 . . . . 0.0 110.646 177.773 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.38 -37.03 76.91 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.664 0.665 . . . . 0.0 111.487 176.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -47.69 -57.53 5.41 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 126.795 2.038 . . . . 0.0 107.929 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -60.3 -31.36 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 119.184 0.902 . . . . 0.0 111.101 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 t -67.25 -45.73 75.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.157 0.435 . . . . 0.0 110.547 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.2 t -75.87 -33.69 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.257 1.423 . . . . 0.0 111.755 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -82.74 -38.23 23.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.425 1.49 . . . . 0.0 108.583 -173.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.28 18.23 67.28 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.0 pt -150.4 143.28 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.37 159.52 26.7 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -175.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -53.6 -41.29 66.47 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.832 1.653 . . . . 0.0 110.15 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.49 -53.84 29.73 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.58 -39.39 93.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.025 0.412 . . . . 0.0 110.924 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -61.31 -48.93 79.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.647 0.779 . . . . 0.0 109.834 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.4 65.91 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.15 -34.78 22.04 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.874 0.869 . . . . 0.0 111.362 175.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -60.98 152.64 69.78 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.685 0.794 . . . . 0.0 110.283 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.36 144.69 39.03 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.272 2.648 . . . . 0.0 112.588 177.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.81 -32.74 41.33 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 123.989 0.804 . . . . 0.0 112.67 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.87 -50.83 54.2 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 117.68 0.74 . . . . 0.0 110.764 174.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.0 -32.62 73.11 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -177.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -61.44 -56.65 17.85 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 122.921 0.488 . . . . 0.0 110.571 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.43 -39.66 94.26 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.431 0.292 . . . . 0.0 110.615 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -51.4 64.36 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.254 1.422 . . . . 0.0 109.814 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 60.7 mmm -61.94 -44.0 97.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.65 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -54.86 -52.25 63.4 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.644 0.656 . . . . 0.0 111.121 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.77 -48.55 80.83 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 111.652 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 . . . . . 0 N--CA 1.455 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 111.023 -173.462 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.51 -33.69 73.0 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.457 1.103 . . . . 0.0 110.733 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -53.31 -52.96 57.44 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 128.98 2.912 . . . . 0.0 108.141 171.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 t -57.21 -32.92 41.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 119.382 0.992 . . . . 0.0 111.049 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.2 t -68.55 -24.11 64.59 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.6 t -105.22 -32.54 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.889 1.675 . . . . 0.0 111.425 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -86.06 -38.82 17.42 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.94 2.096 . . . . 0.0 108.738 -175.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.89 11.59 82.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.075 -0.847 . . . . 0.0 111.155 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.3 pt -142.46 142.12 27.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 118.013 0.907 . . . . 0.0 109.45 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.99 157.92 29.59 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.99 0.9 . . . . 0.0 113.083 -176.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -52.69 -40.11 62.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 126.587 1.955 . . . . 0.0 110.063 170.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.25 -55.16 27.63 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -66.28 -37.66 85.95 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 117.288 0.544 . . . . 0.0 110.701 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -60.38 -48.94 79.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.618 0.767 . . . . 0.0 109.923 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.03 -19.27 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.59 -34.69 21.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.891 0.876 . . . . 0.0 111.317 175.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.31 152.67 71.92 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.817 0.847 . . . . 0.0 110.249 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -51.79 144.98 32.96 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.322 2.682 . . . . 0.0 112.623 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.94 -33.28 43.43 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 123.944 0.783 . . . . 0.0 112.58 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.4 p-90 -68.59 -48.95 62.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.742 0.771 . . . . 0.0 110.752 175.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -62.03 -32.98 73.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.29 -57.67 10.53 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.062 0.545 . . . . 0.0 110.533 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.71 -38.83 92.58 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.57 0.348 . . . . 0.0 110.733 -177.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -51.67 -57.13 10.07 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.283 1.433 . . . . 0.0 109.43 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 69.2 mmm -59.31 -47.05 86.87 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 111.694 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -54.19 -50.18 67.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.466 0.575 . . . . 0.0 111.525 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -60.67 -54.46 45.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.527 0.331 . . . . 0.0 111.273 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 . . . . . 0 CA--C 1.529 0.148 0 C-N-CA 124.948 1.299 . . . . 0.0 112.107 -169.876 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -57.26 -34.75 68.95 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.717 0.807 . . . . 0.0 110.161 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -53.33 -58.52 6.82 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 127.908 2.483 . . . . 0.0 107.91 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.7 t -53.84 -32.47 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 118.733 0.697 . . . . 0.0 111.826 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -66.77 -45.53 78.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.495 0.589 . . . . 0.0 110.914 177.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -80.86 -32.8 12.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 125.464 1.506 . . . . 0.0 112.342 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -88.93 -38.09 14.76 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.881 2.073 . . . . 0.0 108.862 -173.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.2 8.52 86.33 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.907 -0.941 . . . . 0.0 111.258 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.5 pt -141.95 142.75 27.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.323 0 CA-C-N 118.153 0.977 . . . . 0.0 110.493 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.45 160.22 25.39 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 125.268 1.427 . . . . 0.0 113.933 -174.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -51.08 -44.08 61.14 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.801 2.041 . . . . 0.0 109.052 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -53.56 32.16 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -64.0 -37.65 88.21 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.902 0.351 . . . . 0.0 110.995 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -66.69 -45.9 77.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -19.5 65.98 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.18 -36.71 24.47 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.647 0.779 . . . . 0.0 111.01 174.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.28 148.8 84.61 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 123.356 0.662 . . . . 0.0 110.043 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.48 145.22 47.68 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.275 2.65 . . . . 0.0 112.96 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.68 -33.03 33.56 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.296 0.951 . . . . 0.0 112.961 177.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 13.3 p-90 -68.2 -49.89 57.83 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 117.811 0.806 . . . . 0.0 111.025 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.54 -37.51 81.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -59.6 -58.28 9.29 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.556 0.342 . . . . 0.0 110.182 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -38.11 86.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.779 0.432 . . . . 0.0 110.633 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -59.9 -51.58 69.11 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.075 0.55 . . . . 0.0 110.611 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.5 mtp -54.62 -42.09 70.78 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.305 176.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.57 -52.58 64.26 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.012 0.823 . . . . 0.0 111.226 178.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -68.53 -32.49 72.47 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 . . . . . 0 C--N 1.34 0.162 0 C-N-CA 123.885 0.874 . . . . 0.0 110.75 -177.109 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.59 -40.96 80.22 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.762 0.825 . . . . 0.0 111.13 173.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.648 ' HZ ' ' CD1' ' A' ' 18' ' ' PHE . 3.3 t80 -53.1 -58.01 8.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 126.982 2.113 . . . . 0.0 107.822 171.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.3 t -58.1 -34.65 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 119.574 1.079 . . . . 0.0 111.673 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.7 t -64.4 -42.27 96.19 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.511 0.596 . . . . 0.0 111.235 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t -80.94 -35.83 14.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 124.9 1.28 . . . . 0.0 111.431 -176.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.0 -45.14 13.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.188 1.395 . . . . 0.0 109.693 -172.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.5 15.18 76.77 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.816 -0.991 . . . . 0.0 111.03 -173.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.1 pt -110.46 -160.08 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.403 0 CA-C-N 118.301 1.051 . . . . 0.0 108.305 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.65 158.13 30.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.217 1.407 . . . . 0.0 112.853 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -55.14 -39.09 69.06 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 113.12 -1.854 . . . . 0.0 110.56 170.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.99 -55.35 28.67 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.9 -42.46 99.79 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 117.053 0.427 . . . . 0.0 110.705 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.648 ' CD1' ' HZ ' ' A' ' 7' ' ' PHE . 46.8 t80 -57.02 -45.62 82.95 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.042 0.937 . . . . 0.0 111.043 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.43 -19.08 65.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.07 -28.27 22.65 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.927 0.891 . . . . 0.0 111.431 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.06 144.93 90.33 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 177.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -54.07 143.81 60.67 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.298 1.998 . . . . 0.0 111.662 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.19 -32.13 50.28 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 123.384 0.516 . . . . 0.0 112.559 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -65.93 -50.5 64.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.644 0.722 . . . . 0.0 110.676 174.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -60.88 -35.11 75.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -62.07 -54.53 40.14 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.869 0.468 . . . . 0.0 110.546 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.21 -40.58 96.36 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.044 0.538 . . . . 0.0 110.67 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -53.64 56.07 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.777 1.231 . . . . 0.0 110.544 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.1 mmm -59.28 -43.59 92.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.027 0.531 . . . . 0.0 111.233 -177.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -57.36 -49.9 74.7 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.21 -0.424 . . . . 0.0 111.21 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -70.95 -28.9 64.81 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.424 0.557 . . . . 0.0 112.414 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 . . . . . 0 C--N 1.341 0.2 0 C-N-CA 123.64 0.776 . . . . 0.0 110.167 175.974 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 . . . . . 0 CA--C 1.541 0.597 0 CA-C-O 120.325 0.107 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.5 -32.91 69.25 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.979 1.312 . . . . 0.0 111.197 173.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.0 -53.62 56.39 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 128.461 2.704 . . . . 0.0 108.204 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.5 t -53.68 -33.94 23.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.802 0.728 . . . . 0.0 111.476 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.4 t -65.94 -32.22 73.59 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.3 t -97.21 -32.68 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.646 1.578 . . . . 0.0 111.511 -174.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -87.17 -41.0 14.09 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.06 1.744 . . . . 0.0 109.179 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.31 85.02 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 119.026 -0.874 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.41 144.13 29.58 Favored 'Isoleucine or valine' 0 C--N 1.344 0.357 0 CA-C-N 118.094 0.947 . . . . 0.0 110.053 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.07 158.97 27.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.31 1.052 . . . . 0.0 113.485 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -52.19 -40.76 61.95 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.211 2.205 . . . . 0.0 110.032 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.88 -54.37 31.28 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.217 0.913 . . . . 0.0 111.142 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -59.03 -46.02 89.26 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 117.229 0.514 . . . . 0.0 110.782 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -61.67 -46.69 88.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.052 0.541 . . . . 0.0 110.405 -176.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.06 -19.32 65.81 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 178.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.12 -34.87 20.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.893 0.877 . . . . 0.0 111.22 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.1 mt -61.36 150.4 80.26 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.763 0.825 . . . . 0.0 109.907 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.0 144.86 35.23 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.329 2.686 . . . . 0.0 112.622 177.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.19 -33.02 44.67 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.882 0.753 . . . . 0.0 112.71 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.77 -50.38 57.42 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.61 0.705 . . . . 0.0 110.673 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -62.15 -33.09 73.84 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.79 -57.82 11.05 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 122.98 0.512 . . . . 0.0 110.392 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -38.56 91.63 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.55 0.34 . . . . 0.0 110.848 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.52 -54.63 38.49 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.248 1.419 . . . . 0.0 109.908 174.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -59.53 -41.7 90.6 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 118.788 -0.625 . . . . 0.0 112.268 178.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -57.33 -50.72 72.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.953 0.797 . . . . 0.0 111.019 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.72 -44.25 93.82 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.863 0.465 . . . . 0.0 112.001 176.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 . . . . . 0 CA--C 1.528 0.126 0 C-N-CA 123.842 0.857 . . . . 0.0 111.539 -174.078 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.22 -38.42 83.31 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.542 0.61 . . . . 0.0 111.51 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -49.56 -59.75 3.48 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 126.675 1.99 . . . . 0.0 107.472 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -54.23 -37.78 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.284 0.947 . . . . 0.0 112.653 177.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.7 t -64.09 -41.43 97.29 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.238 0.472 . . . . 0.0 111.453 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.4 t -83.57 -31.54 8.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.82 1.648 . . . . 0.0 111.509 -176.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.74 -38.82 19.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.863 1.265 . . . . 0.0 108.907 -170.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.04 24.04 55.94 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.2 pp -133.71 -169.83 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.06 158.21 20.62 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.609 1.164 . . . . 0.0 112.569 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -51.58 -39.49 57.97 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.365 -1.743 . . . . 0.0 110.097 170.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.31 -54.39 27.13 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.08 -45.34 87.29 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.038 0.535 . . . . 0.0 110.74 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -59.3 -46.8 87.59 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.619 0.768 . . . . 0.0 110.435 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.52 -18.65 65.48 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.42 -33.96 16.64 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.907 . . . . 0.0 111.225 175.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.07 151.2 86.83 Favored Pre-proline 0 CA--C 1.536 0.434 0 C-N-CA 123.614 0.766 . . . . 0.0 110.034 -177.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.58 144.47 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.194 2.596 . . . . 0.0 112.564 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.41 -31.92 44.1 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.001 0.81 . . . . 0.0 112.628 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -68.28 -50.39 53.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.771 0.786 . . . . 0.0 110.635 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.96 -33.14 73.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -177.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -61.03 -57.52 12.25 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 123.023 0.529 . . . . 0.0 110.319 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.56 -37.65 88.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.79 0.436 . . . . 0.0 110.926 -176.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -53.98 47.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.243 1.417 . . . . 0.0 109.543 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 62.0 mtm -62.33 -40.05 95.09 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.197 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.53 -52.25 65.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.899 0.772 . . . . 0.0 111.062 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -58.17 -47.46 83.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 175.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.285 0.634 . . . . 0.0 111.105 -169.958 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 . . . . . 0 CA--C 1.535 0.391 0 CA-C-O 119.688 -0.196 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.23 -38.61 77.19 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.407 0.683 . . . . 0.0 109.611 175.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.416 ' CE2' ' CD2' ' A' ' 11' ' ' PHE . 9.0 t80 -57.62 -61.11 2.74 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.855 2.062 . . . . 0.0 107.479 173.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -50.55 -38.13 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 120.09 1.314 . . . . 0.0 112.138 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 t -60.82 -35.09 75.63 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.7 t -99.06 -33.06 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 125.949 1.699 . . . . 0.0 111.99 -173.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.416 ' CD2' ' CE2' ' A' ' 7' ' ' PHE . 12.8 m-85 -90.83 -39.05 12.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.559 1.943 . . . . 0.0 109.355 -169.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.44 6.15 89.43 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.545 -1.141 . . . . 0.0 111.399 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.6 pt -123.6 140.86 45.87 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.343 1.071 . . . . 0.0 110.348 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.3 159.06 30.04 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.72 1.208 . . . . 0.0 113.455 -175.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -53.79 -39.74 65.7 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 126.575 1.95 . . . . 0.0 110.451 169.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.09 -54.88 32.98 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.173 0.892 . . . . 0.0 110.9 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -65.3 -40.31 93.64 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 117.468 0.634 . . . . 0.0 110.82 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -57.21 -48.96 77.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.678 0.791 . . . . 0.0 110.798 174.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.81 -19.69 65.79 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.33 -35.61 25.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.618 0.767 . . . . 0.0 111.0 174.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.96 147.39 90.07 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.73 145.23 50.38 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.725 2.283 . . . . 0.0 112.66 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.88 -33.04 35.08 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.165 0.888 . . . . 0.0 112.725 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.71 -50.63 56.51 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 117.672 0.736 . . . . 0.0 110.975 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.9 tptp -62.22 -34.2 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -61.36 -58.3 8.77 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.503 0.721 . . . . 0.0 110.183 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -38.79 91.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.37 0.668 . . . . 0.0 110.62 -175.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -59.31 -55.0 40.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.803 0.441 . . . . 0.0 109.999 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.6 mmm -56.19 -42.9 77.87 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.79 0.836 . . . . 0.0 112.4 -177.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -54.27 -55.11 31.46 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.578 0.351 . . . . 0.0 110.896 174.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -63.92 -33.64 76.17 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.776 0.83 . . . . 0.0 112.925 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 . . . . . 0 N--CA 1.456 -0.132 0 C-N-CA 124.19 0.996 . . . . 0.0 111.274 -175.961 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 CA--C 1.538 0.493 0 N-CA-C 111.3 0.111 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -40.22 93.34 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.687 0.795 . . . . 0.0 109.714 175.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -50.58 -62.0 1.86 Allowed 'General case' 0 C--O 1.216 -0.684 0 C-N-CA 127.727 2.411 . . . . 0.0 107.397 170.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 t -50.95 -39.16 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.577 1.081 . . . . 0.0 112.201 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -65.03 -31.34 72.52 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -101.11 -27.72 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 125.818 1.647 . . . . 0.0 111.545 -173.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -85.2 -45.62 11.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.47 1.908 . . . . 0.0 108.393 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.75 13.32 80.05 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -175.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.07 141.86 37.22 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 118.132 0.966 . . . . 0.0 109.929 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.72 161.91 27.29 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.901 1.28 . . . . 0.0 113.358 -177.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -56.36 -41.75 76.66 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.564 1.946 . . . . 0.0 108.134 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.45 -53.43 28.7 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -63.24 -38.78 92.51 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.515 0.326 . . . . 0.0 110.943 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.55 -48.15 80.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.941 0.496 . . . . 0.0 109.673 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.84 -19.67 65.99 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.88 -35.71 23.93 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.851 0.86 . . . . 0.0 111.123 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -61.2 151.51 75.63 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.588 0.755 . . . . 0.0 109.902 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -53.53 145.77 45.72 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.124 2.55 . . . . 0.0 112.939 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.11 -33.64 30.42 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 124.465 1.031 . . . . 0.0 112.853 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -68.44 -50.65 51.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 117.658 0.729 . . . . 0.0 111.049 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.75 -34.63 76.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -61.33 -57.51 12.02 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.253 0.621 . . . . 0.0 110.395 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -39.81 95.55 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.059 -176.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.27 -54.67 44.11 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.975 0.51 . . . . 0.0 110.028 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.9 mmm -54.49 -44.41 72.65 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.275 0.63 . . . . 0.0 112.153 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -56.24 -50.47 71.2 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.115 0.416 . . . . 0.0 111.779 176.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -63.05 -45.0 94.31 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 118.169 0.441 . . . . 0.0 111.973 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 . . . . . 0 N--CA 1.453 -0.31 0 C-N-CA 123.7 0.8 . . . . 0.0 111.399 -169.246 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -38.58 74.25 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.915 0.864 . . . . 0.0 111.588 173.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -51.26 -57.29 9.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 128.229 2.611 . . . . 0.0 107.761 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.8 t -53.69 -33.45 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 119.124 0.875 . . . . 0.0 112.184 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -67.81 -42.68 81.19 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.543 0.61 . . . . 0.0 111.164 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.2 t -82.13 -31.59 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 125.527 1.531 . . . . 0.0 112.229 -175.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -89.15 -40.85 12.62 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.457 1.903 . . . . 0.0 108.733 -173.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.49 10.39 83.5 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 118.997 -0.891 . . . . 0.0 111.092 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.9 pt -141.85 144.61 25.31 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 118.153 0.977 . . . . 0.0 110.149 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.12 159.75 25.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 124.852 1.261 . . . . 0.0 113.73 -175.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -53.08 -42.14 65.6 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 113.045 -1.888 . . . . 0.0 109.267 169.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.74 -54.79 28.81 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -65.71 -36.4 83.51 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 117.243 0.522 . . . . 0.0 110.957 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -63.1 -47.72 81.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.801 0.441 . . . . 0.0 110.226 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.46 -19.6 66.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 177.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.39 -36.72 24.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.681 0.793 . . . . 0.0 111.039 175.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.16 148.43 84.8 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.594 0.757 . . . . 0.0 109.621 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -52.92 145.94 38.71 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.207 2.604 . . . . 0.0 112.88 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.81 -33.66 35.68 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.301 0.953 . . . . 0.0 112.781 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -68.44 -49.73 57.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.762 0.781 . . . . 0.0 110.982 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -61.01 -36.92 80.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -59.52 -58.0 10.49 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 122.98 0.512 . . . . 0.0 110.119 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -38.2 88.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.911 0.484 . . . . 0.0 110.501 -175.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -58.43 -52.79 64.16 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 119.177 -0.439 . . . . 0.0 110.32 176.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.3 mtp -54.59 -41.06 69.47 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.293 -0.86 . . . . 0.0 112.706 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -55.55 -53.59 54.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.296 0.953 . . . . 0.0 110.669 176.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -58.82 -47.81 83.51 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.268 0.627 . . . . 0.0 111.591 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 CA--C 1.528 0.114 0 C-N-CA 125.25 1.42 . . . . 0.0 111.129 -172.868 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 . . . . . 0 CA--C 1.537 0.455 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.2 -38.84 77.53 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.884 0.874 . . . . 0.0 109.878 174.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -55.38 -58.08 9.19 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.964 2.106 . . . . 0.0 107.845 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 13' ' ' ILE . 3.5 t -53.17 -36.13 24.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 120.4 1.455 . . . . 0.0 111.693 177.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.2 t -65.02 -39.38 93.3 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.558 0.617 . . . . 0.0 111.646 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.7 t -84.83 -32.82 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.539 1.536 . . . . 0.0 111.81 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -93.35 -49.52 5.9 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.404 1.881 . . . . 0.0 109.75 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.29 9.56 84.84 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.304 -1.275 . . . . 0.0 111.228 -170.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.401 ' O ' HG22 ' A' ' 8' ' ' VAL . 3.2 pt -117.63 140.96 38.6 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 CA-C-N 118.814 1.307 . . . . 0.0 110.286 175.385 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.97 158.3 34.98 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.769 1.228 . . . . 0.0 113.649 -175.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -52.88 -39.96 63.09 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.496 2.318 . . . . 0.0 110.307 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.51 -52.85 48.43 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -65.02 -43.13 93.44 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 117.653 0.727 . . . . 0.0 110.737 -177.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.07 -48.32 73.66 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.021 0.529 . . . . 0.0 111.324 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.54 65.5 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.22 -34.19 23.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.798 0.839 . . . . 0.0 111.102 174.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 mt -61.61 144.59 92.57 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -53.42 145.22 46.97 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.813 2.342 . . . . 0.0 112.487 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.02 -33.49 36.93 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.989 0.804 . . . . 0.0 112.824 178.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.39 -49.44 63.85 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 117.562 0.681 . . . . 0.0 110.921 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.75 -37.98 83.64 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -59.35 -55.91 28.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.12 0.568 . . . . 0.0 110.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.08 -37.14 86.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.095 0.558 . . . . 0.0 110.391 -176.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -62.72 -51.94 65.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.415 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.4 mtp -54.72 -45.45 74.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.711 0.687 . . . . 0.0 112.735 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -51.04 -55.28 18.28 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.05 0.54 . . . . 0.0 110.242 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -66.09 -36.67 83.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.782 0.833 . . . . 0.0 112.68 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 . . . . . 0 C--N 1.339 0.14 0 C-N-CA 124.475 1.11 . . . . 0.0 110.842 -176.753 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 . . . . . 0 CA--C 1.533 0.325 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.01 -37.29 66.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.986 0.914 . . . . 0.0 110.457 173.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.27 -58.4 7.21 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 127.338 2.255 . . . . 0.0 107.287 170.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.72 -32.89 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 119.284 0.947 . . . . 0.0 111.133 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -65.64 -48.1 73.34 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.056 0.389 . . . . 0.0 110.632 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.5 t -75.0 -32.71 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.155 1.382 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -83.06 -38.02 23.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.971 1.709 . . . . 0.0 108.409 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.66 17.04 69.13 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 pt -150.8 142.11 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.35 160.91 23.64 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -176.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -52.9 -39.7 62.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 113.624 -1.625 . . . . 0.0 109.86 169.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.26 -55.52 23.18 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -58.51 -45.22 89.2 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.745 0.418 . . . . 0.0 110.967 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -60.43 -48.16 82.98 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.779 0.832 . . . . 0.0 110.245 -178.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.86 -19.52 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.81 -34.76 22.66 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.728 0.811 . . . . 0.0 111.194 175.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.68 150.78 80.71 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.566 0.746 . . . . 0.0 109.812 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -53.31 145.82 43.18 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.082 2.521 . . . . 0.0 112.876 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.43 -33.44 32.46 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.373 0.987 . . . . 0.0 112.751 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.99 -51.02 52.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.645 0.723 . . . . 0.0 110.999 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -61.95 -34.07 75.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -61.46 -57.55 11.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.302 0.641 . . . . 0.0 110.36 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -39.46 94.17 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 122.651 0.38 . . . . 0.0 110.335 -176.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -59.25 -52.04 67.39 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.086 0.554 . . . . 0.0 110.341 176.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 51.7 mmm -54.99 -44.23 74.3 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.352 0.661 . . . . 0.0 112.208 178.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -56.32 -51.03 69.74 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.395 0.543 . . . . 0.0 110.885 177.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.92 -44.51 94.26 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.015 0.526 . . . . 0.0 111.924 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.457 -0.099 0 C-N-CA 124.538 1.135 . . . . 0.0 111.002 -171.585 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 120.363 0.125 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.37 80.73 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 111.714 173.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -53.37 -53.65 48.1 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 129.135 2.974 . . . . 0.0 107.837 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 t -54.2 -31.97 22.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.162 0.892 . . . . 0.0 111.955 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.1 t -67.45 -43.9 79.97 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.321 0.51 . . . . 0.0 110.969 176.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.48 -32.95 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.85 1.66 . . . . 0.0 112.389 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -88.48 -41.26 12.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.768 2.027 . . . . 0.0 108.888 -172.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.55 11.5 81.78 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 119.085 -0.842 . . . . 0.0 111.104 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.6 pt -142.64 142.55 26.59 Favored 'Isoleucine or valine' 0 C--N 1.343 0.308 0 CA-C-N 117.945 0.873 . . . . 0.0 109.78 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.38 158.93 22.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.321 1.049 . . . . 0.0 113.58 -175.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -54.33 -41.68 69.33 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 126.201 1.8 . . . . 0.0 110.164 169.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.14 -53.74 31.57 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 177.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -63.29 -39.57 94.95 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 117.264 0.532 . . . . 0.0 110.967 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -63.02 -48.18 79.9 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.334 0.654 . . . . 0.0 109.837 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.17 -19.53 66.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.44 0.534 . . . . 0.0 112.44 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.53 -35.7 22.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.787 0.835 . . . . 0.0 111.228 175.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.2 mt -61.07 150.37 78.92 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.618 0.767 . . . . 0.0 109.774 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.03 145.44 41.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.221 2.614 . . . . 0.0 112.803 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.52 -33.3 32.9 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.275 0.94 . . . . 0.0 112.804 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -67.64 -51.19 52.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.716 0.758 . . . . 0.0 110.97 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -62.01 -34.03 75.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -61.5 -58.6 7.5 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.024 0.529 . . . . 0.0 110.05 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -38.69 90.19 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.985 0.514 . . . . 0.0 110.465 -175.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -51.07 71.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.88 0.472 . . . . 0.0 110.202 175.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mmm -57.13 -39.15 74.59 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.927 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -57.62 -53.58 56.61 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.18 0.9 . . . . 0.0 110.505 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -56.95 -46.06 82.36 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.586 0.754 . . . . 0.0 111.692 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 . . . . . 0 N--CA 1.456 -0.161 0 C-N-CA 124.516 1.126 . . . . 0.0 110.905 -171.866 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.26 72.01 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.249 1.019 . . . . 0.0 111.457 172.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.51 -58.86 4.79 Favored 'General case' 0 CA--C 1.505 -0.759 0 C-N-CA 127.557 2.343 . . . . 0.0 107.785 173.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.5 t -59.24 -32.12 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 118.761 0.71 . . . . 0.0 111.2 -177.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.8 t -66.47 -46.29 76.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.031 0.378 . . . . 0.0 110.558 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.5 t -77.29 -32.44 18.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.297 1.439 . . . . 0.0 111.981 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -84.81 -39.39 18.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.929 1.692 . . . . 0.0 108.449 -173.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.22 16.89 70.62 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.2 pt -148.9 142.83 18.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.7 158.35 24.87 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -52.77 -41.56 64.18 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.226 1.81 . . . . 0.0 110.021 169.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.67 -54.12 30.71 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.13 -36.33 83.93 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 117.451 0.625 . . . . 0.0 110.974 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -61.67 -47.36 85.7 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.156 0.583 . . . . 0.0 109.974 177.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.79 -19.12 65.77 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.23 -36.23 22.89 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.731 0.812 . . . . 0.0 111.083 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 mt -61.31 153.1 70.13 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 123.893 0.877 . . . . 0.0 109.797 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.19 150.8 87.14 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.616 2.211 . . . . 0.0 111.195 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.42 -34.12 25.96 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.915 1.245 . . . . 0.0 112.808 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -68.53 -51.16 45.99 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.712 0.756 . . . . 0.0 110.751 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -62.31 -32.49 73.25 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -61.5 -57.22 13.01 Favored 'General case' 0 C--N 1.342 0.248 0 C-N-CA 123.308 0.643 . . . . 0.0 110.664 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.17 -38.56 91.51 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 122.701 0.401 . . . . 0.0 110.663 -176.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -51.86 67.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.865 1.266 . . . . 0.0 109.958 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.9 mmm -59.32 -46.81 87.56 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.338 0.655 . . . . 0.0 111.627 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -54.58 -49.62 69.94 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.5 0.591 . . . . 0.0 111.349 177.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.3 mtmt -60.96 -47.37 86.76 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.849 0.295 . . . . 0.0 111.462 176.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 . . . . . 0 CA--C 1.527 0.087 0 C-N-CA 123.589 0.755 . . . . 0.0 111.473 -172.869 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 CA--C 1.538 0.507 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.28 -39.03 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.87 0.868 . . . . 0.0 111.597 174.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -49.82 -56.02 11.99 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 127.298 2.239 . . . . 0.0 107.75 171.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.07 -30.73 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 119.197 0.908 . . . . 0.0 111.214 -177.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.81 -48.64 68.33 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.429 0.559 . . . . 0.0 110.232 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.1 t -73.42 -32.15 35.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 125.302 1.441 . . . . 0.0 112.023 -177.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -86.44 -23.25 26.11 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.169 1.787 . . . . 0.0 109.61 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.35 28.18 19.17 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 124.694 1.14 . . . . 0.0 112.82 -172.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 19.9 pt -145.29 143.74 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 172.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.24 158.88 27.76 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.903 0.858 . . . . 0.0 113.274 -176.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -54.67 -40.45 69.09 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.944 1.697 . . . . 0.0 109.9 170.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.6 -54.39 29.2 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.141 0.877 . . . . 0.0 110.92 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -64.35 -38.18 90.13 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 117.353 0.577 . . . . 0.0 110.859 -178.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.11 -49.66 77.02 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.611 0.764 . . . . 0.0 109.941 176.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.2 65.75 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.73 -34.07 21.31 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.93 0.892 . . . . 0.0 111.414 175.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -61.63 154.04 67.69 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.679 0.792 . . . . 0.0 110.452 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.09 144.77 36.33 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.312 2.674 . . . . 0.0 112.619 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.66 -32.78 40.34 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.014 0.816 . . . . 0.0 112.595 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -68.1 -51.47 46.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.718 0.759 . . . . 0.0 110.808 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -61.58 -32.99 73.12 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -61.78 -58.73 6.87 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.127 0.571 . . . . 0.0 110.508 176.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -37.49 86.01 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 122.721 0.408 . . . . 0.0 111.072 -176.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -54.43 47.09 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.957 1.303 . . . . 0.0 109.984 175.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.3 mmm -56.78 -43.39 80.82 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 119.159 -0.448 . . . . 0.0 111.559 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -59.7 -48.36 81.98 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 118.929 -0.558 . . . . 0.0 111.865 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.52 70.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.844 0.747 . . . . 0.0 111.722 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 109.682 -177.278 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.59 -41.09 89.47 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.217 1.008 . . . . 0.0 111.1 174.203 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.9 -52.25 61.13 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.328 3.051 . . . . 0.0 108.293 174.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -52.97 -30.99 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 119.884 1.22 . . . . 0.0 112.045 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.1 t -68.85 -46.65 67.94 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.825 0.739 . . . . 0.0 110.865 176.668 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 85.8 t -78.08 -28.61 15.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.762 1.625 . . . . 0.0 112.468 -174.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -94.31 -30.03 14.74 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 126.908 2.083 . . . . 0.0 110.146 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 50.52 26.87 10.72 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.98 0.8 . . . . 0.0 112.927 -169.704 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.12 141.31 41.93 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 CA-C-N 117.84 0.82 . . . . 0.0 109.372 169.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.39 161.32 29.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 125.007 1.323 . . . . 0.0 113.408 -176.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -54.22 -41.21 68.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.875 1.67 . . . . 0.0 109.762 169.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.75 -54.33 26.02 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 110.714 -0.955 . . . . 0.0 110.714 -179.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -63.44 -38.84 92.71 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.833 0.453 . . . . 0.0 111.058 -179.169 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.74 -47.73 82.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.29 0.636 . . . . 0.0 109.795 177.815 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.33 -19.54 66.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.74 -35.64 24.25 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.803 0.841 . . . . 0.0 110.977 175.436 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 mt -60.7 152.05 69.37 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.597 0.759 . . . . 0.0 109.682 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.78 144.22 44.64 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.977 2.451 . . . . 0.0 112.41 177.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -31.64 47.12 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 123.864 0.745 . . . . 0.0 112.509 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.0 p-90 -68.08 -50.98 51.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.668 0.734 . . . . 0.0 110.601 174.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 tptp -62.49 -31.78 72.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -176.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -62.2 -57.98 9.46 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.324 0.65 . . . . 0.0 110.58 176.155 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.58 84.53 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.886 0.475 . . . . 0.0 110.551 -176.216 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -53.08 62.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.696 1.198 . . . . 0.0 109.646 175.294 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.8 mmm -58.78 -45.34 90.06 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.945 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -53.34 -52.47 59.11 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.456 0.571 . . . . 0.0 111.134 174.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -60.39 -43.09 96.96 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.584 0.754 . . . . 0.0 111.611 178.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.122 0 C-N-CA 124.053 0.941 . . . . 0.0 110.868 -171.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 . . . . . 0 CA--C 1.539 0.527 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.85 -37.26 63.46 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.375 1.07 . . . . 0.0 110.712 172.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -52.43 -58.7 5.89 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 127.216 2.207 . . . . 0.0 107.881 170.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -59.16 -31.99 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 118.778 0.717 . . . . 0.0 110.939 -176.81 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -65.28 -49.03 71.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.023 0.374 . . . . 0.0 110.455 177.439 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.3 t -75.16 -33.48 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.449 1.1 . . . . 0.0 111.868 -177.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -80.86 -34.71 33.54 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.054 1.742 . . . . 0.0 108.819 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.49 16.0 74.71 Favored Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 177.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.7 pt -151.31 144.9 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 -175.425 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.28 158.32 29.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.0 0.905 . . . . 0.0 113.235 -177.591 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.8 ttt180 -53.83 -39.6 65.7 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.281 1.832 . . . . 0.0 110.086 170.42 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.93 -54.84 27.99 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.07 0.843 . . . . 0.0 111.042 177.176 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.01 -36.56 84.77 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 117.437 0.619 . . . . 0.0 110.954 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -59.76 -48.86 79.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.817 0.847 . . . . 0.0 109.994 175.056 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.15 -19.38 65.95 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 178.459 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.64 -34.95 22.97 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.836 0.854 . . . . 0.0 111.353 175.193 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.04 152.89 58.81 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.57 0.748 . . . . 0.0 110.275 179.249 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.13 144.49 37.7 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.24 2.627 . . . . 0.0 112.514 177.552 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.17 -32.13 42.77 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 123.988 0.804 . . . . 0.0 112.496 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -68.29 -50.69 51.93 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.685 0.743 . . . . 0.0 110.734 175.157 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -61.94 -32.96 73.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.782 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -61.11 -57.69 11.47 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.883 0.473 . . . . 0.0 110.599 176.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -38.58 91.69 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.519 0.328 . . . . 0.0 110.684 -177.149 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -52.33 63.87 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.303 1.441 . . . . 0.0 109.691 175.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.2 mmm -58.7 -49.09 78.86 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.511 0.596 . . . . 0.0 111.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -57.4 -47.24 82.24 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.569 0.348 . . . . 0.0 111.268 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtmt -62.35 -44.71 95.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.852 0.461 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 C--N 1.339 0.129 0 C-N-CA 124.734 1.213 . . . . 0.0 111.588 -172.979 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.18 -39.39 86.34 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.476 0.58 . . . . 0.0 111.63 174.304 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -51.52 -61.41 2.26 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 127.171 2.188 . . . . 0.0 107.367 170.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -53.14 -38.86 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.048 0.84 . . . . 0.0 112.342 178.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.9 t -62.05 -39.78 93.53 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 117.918 0.326 . . . . 0.0 111.463 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -89.32 -30.46 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.479 1.512 . . . . 0.0 111.823 -175.132 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.77 -39.37 18.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.095 1.358 . . . . 0.0 108.815 -169.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.13 23.63 56.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.072 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -130.39 -165.6 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 172.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.03 159.17 25.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 124.939 1.296 . . . . 0.0 112.499 170.755 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -50.46 -41.17 52.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.162 2.185 . . . . 0.0 110.239 169.877 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.26 -53.83 30.63 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 179.149 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -59.81 -45.46 92.28 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.025 0.53 . . . . 0.0 110.758 178.792 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -61.41 -44.91 96.33 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.326 0.65 . . . . 0.0 110.139 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -18.44 65.33 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 178.638 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -33.83 15.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.059 0.944 . . . . 0.0 111.311 176.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -62.5 152.73 79.67 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.691 0.797 . . . . 0.0 110.668 -176.237 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -52.54 144.62 40.84 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.355 2.703 . . . . 0.0 112.544 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.34 -32.94 45.51 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.982 0.801 . . . . 0.0 112.638 178.042 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -68.67 -49.18 61.11 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.774 0.787 . . . . 0.0 110.718 175.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -61.92 -32.87 73.31 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -62.52 -58.06 8.92 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.198 0.599 . . . . 0.0 110.344 176.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 -35.79 81.79 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.798 0.439 . . . . 0.0 110.978 -177.085 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -56.27 -55.39 33.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.875 1.67 . . . . 0.0 110.096 175.336 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.6 mmm -56.24 -46.48 79.55 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.777 0.431 . . . . 0.0 110.915 177.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -56.7 -50.03 73.37 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 178.163 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -71.12 -30.97 67.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.65 0.659 . . . . 0.0 111.287 -177.108 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.164 0.585 . . . . 0.0 110.898 -177.694 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.09 -37.97 67.51 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.408 0.623 . . . . 0.0 110.085 174.498 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -49.93 -59.65 3.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 127.549 2.34 . . . . 0.0 107.958 169.927 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.2 t -58.76 -32.76 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 119.101 0.864 . . . . 0.0 110.881 -177.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.3 t -65.25 -45.43 84.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.016 0.371 . . . . 0.0 110.822 178.628 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.3 t -80.3 -33.37 14.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.376 1.07 . . . . 0.0 111.718 -176.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -79.83 -35.2 38.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.988 1.715 . . . . 0.0 108.634 -175.736 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.33 15.89 75.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 177.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.0 pt -150.28 144.01 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.165 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.95 158.43 30.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 122.102 0.953 . . . . 0.0 113.237 -176.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -52.54 -39.86 61.89 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 126.456 1.902 . . . . 0.0 110.217 169.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.03 -55.3 25.01 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.139 0.876 . . . . 0.0 111.05 177.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.14 -35.68 81.86 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 117.357 0.578 . . . . 0.0 111.042 -178.246 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -60.7 -48.38 82.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.648 0.779 . . . . 0.0 110.005 175.298 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.24 65.84 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.224 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.4 -35.13 23.33 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.834 0.854 . . . . 0.0 111.211 175.117 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.25 152.92 60.93 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 123.54 0.736 . . . . 0.0 110.339 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.61 144.51 41.9 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.225 2.617 . . . . 0.0 112.578 177.722 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.86 -32.68 41.6 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.057 0.837 . . . . 0.0 112.591 177.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -68.26 -50.39 54.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.634 0.717 . . . . 0.0 110.779 175.32 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -62.07 -33.0 73.6 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.17 -57.44 12.46 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.04 0.536 . . . . 0.0 110.71 176.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -39.4 94.22 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.545 0.338 . . . . 0.0 110.651 -177.219 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.35 55.08 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.217 1.407 . . . . 0.0 109.489 175.634 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 45.8 mmm -58.41 -47.48 83.79 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 111.58 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -55.61 -49.62 72.33 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.392 0.277 . . . . 0.0 111.404 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -64.06 -42.64 96.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 178.15 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 . . . . . 0 CA--C 1.529 0.143 0 C-N-CA 125.002 1.321 . . . . 0.0 112.271 -173.358 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 . . . . . 0 CA--C 1.537 0.446 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -58.84 -34.46 71.58 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.038 0.935 . . . . 0.0 110.464 173.679 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -57.92 -58.93 6.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.637 1.975 . . . . 0.0 107.205 171.53 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.99 -38.13 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 119.46 1.027 . . . . 0.0 111.965 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.2 t -61.37 -45.62 93.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.909 0.322 . . . . 0.0 111.197 178.863 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.79 -34.11 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.934 1.294 . . . . 0.0 111.984 -175.239 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -85.14 -36.25 21.2 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.524 1.53 . . . . 0.0 109.01 -170.622 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.83 7.4 88.04 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 178.494 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.0 pt -139.21 146.99 24.95 Favored 'Isoleucine or valine' 0 C--N 1.341 0.233 0 CA-C-N 117.786 0.793 . . . . 0.0 110.162 -177.725 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -62.54 156.91 21.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 122.174 0.988 . . . . 0.0 113.02 -177.286 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.8 ttp180 -57.39 -39.05 75.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.22 -1.809 . . . . 0.0 108.805 172.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.44 -53.18 33.8 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.352 0.977 . . . . 0.0 111.105 177.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -64.91 -36.66 85.1 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 117.815 0.807 . . . . 0.0 110.779 -178.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -60.91 -48.33 82.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.788 0.435 . . . . 0.0 110.608 176.092 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.38 65.85 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 178.026 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.62 -35.79 22.46 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.801 0.84 . . . . 0.0 111.142 175.069 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.24 150.45 79.48 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.568 0.747 . . . . 0.0 109.858 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.14 144.46 37.88 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.164 2.576 . . . . 0.0 112.493 176.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.69 -32.0 46.38 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.912 0.768 . . . . 0.0 112.608 178.122 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -67.57 -50.61 57.59 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.78 0.79 . . . . 0.0 110.612 174.463 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.04 -32.25 72.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.656 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.75 -57.54 11.51 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 122.83 0.452 . . . . 0.0 110.481 176.487 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -37.18 86.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.705 0.402 . . . . 0.0 110.873 -176.524 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -53.53 55.94 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.315 1.446 . . . . 0.0 109.451 173.979 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.9 mmm -57.66 -42.63 83.93 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.525 0.602 . . . . 0.0 111.334 178.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -57.57 -52.03 67.08 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.708 177.488 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.36 -35.32 77.56 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.313 0.506 . . . . 0.0 111.514 -176.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -175.783 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.024 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -81.74 39.7 0.56 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.86 1.264 . . . . 0.0 111.639 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -172.7 130.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.063 1.745 . . . . 0.0 108.103 -177.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 m -44.14 146.88 0.58 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.378 1.871 . . . . 0.0 111.356 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -55.19 -28.6 54.17 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.756 0.823 . . . . 0.0 111.958 -175.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.51 -46.59 15.58 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.509 0.723 . . . . 0.0 111.576 177.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.69 -37.32 75.79 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 124.304 1.042 . . . . 0.0 110.285 175.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -54.38 -60.87 2.76 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 127.51 2.324 . . . . 0.0 107.427 171.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.4 t -51.62 -38.92 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.33 0.968 . . . . 0.0 112.513 177.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -62.68 -41.72 99.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.186 0.448 . . . . 0.0 111.524 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.2 t -84.53 -31.82 7.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.465 1.506 . . . . 0.0 112.124 -175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -87.23 -31.81 20.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.894 1.678 . . . . 0.0 109.717 -170.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.0 20.76 64.48 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -132.59 -168.07 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.48 157.02 23.5 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 124.948 1.299 . . . . 0.0 112.253 169.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt180 -54.27 -38.97 66.44 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 113.664 -1.607 . . . . 0.0 110.009 172.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.58 -54.83 20.59 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -62.55 -37.6 86.76 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 123.006 0.522 . . . . 0.0 111.075 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -62.5 -47.81 82.33 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.545 0.738 . . . . 0.0 110.131 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.87 -19.22 65.78 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.24 -35.55 21.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.893 0.877 . . . . 0.0 111.191 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -60.6 151.71 69.82 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 123.513 0.725 . . . . 0.0 110.138 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.24 144.46 38.79 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 123.223 2.615 . . . . 0.0 112.524 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.92 -31.78 47.75 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 123.848 0.737 . . . . 0.0 112.565 178.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.9 p-90 -67.87 -49.95 59.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 117.747 0.773 . . . . 0.0 110.768 174.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.63 -34.37 75.55 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 -177.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -60.2 -57.7 11.7 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 122.708 0.403 . . . . 0.0 110.527 177.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -36.69 84.86 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.878 0.471 . . . . 0.0 110.928 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -53.92 49.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.837 1.255 . . . . 0.0 109.509 174.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 83.0 mtp -59.36 -46.01 89.82 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.876 0.762 . . . . 0.0 112.243 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -52.73 -53.13 52.09 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.037 0.38 . . . . 0.0 110.558 177.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 mmmm -66.15 -37.76 86.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.759 0.824 . . . . 0.0 112.648 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -60.46 -43.53 96.79 Favored 'General case' 0 CA--C 1.527 0.089 0 C-N-CA 124.426 1.09 . . . . 0.0 111.534 -176.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.2 mptp? -59.17 -29.46 67.47 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 117.95 0.341 . . . . 0.0 111.162 173.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.4 -91.58 0.13 Allowed Glycine 0 CA--C 1.53 0.971 0 N-CA-C 109.696 -1.361 . . . . 0.0 109.696 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -164.28 31.26 0.07 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.901 1.28 . . . . 0.0 111.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.9 t80 . . . . . 0 C--O 1.25 1.093 0 C-N-CA 127.403 2.281 . . . . 0.0 112.474 -174.143 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.041 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -84.09 24.6 0.92 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.612 1.165 . . . . 0.0 112.012 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -168.6 129.48 1.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.467 1.507 . . . . 0.0 108.139 -170.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.9 p -47.85 151.45 0.9 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.0 1.32 . . . . 0.0 111.059 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.67 -23.32 40.94 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -82.78 -48.09 11.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.222 1.009 . . . . 0.0 111.946 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.03 -32.67 71.12 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.436 0.694 . . . . 0.0 110.157 176.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -51.99 -56.64 13.0 Favored 'General case' 0 C--O 1.215 -0.717 0 C-N-CA 127.629 2.372 . . . . 0.0 108.13 171.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.5 t -54.97 -30.34 23.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 119.156 0.889 . . . . 0.0 111.687 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 t -68.25 -47.52 67.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.625 0.648 . . . . 0.0 110.898 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.2 t -77.28 -32.74 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.081 1.353 . . . . 0.0 112.138 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -87.53 -42.69 12.57 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.382 1.873 . . . . 0.0 108.614 -172.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.61 7.87 87.62 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.812 -0.994 . . . . 0.0 110.861 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.4 pt -137.1 142.33 37.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.302 1.051 . . . . 0.0 110.857 -176.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -70.26 162.56 28.24 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 126.346 1.859 . . . . 0.0 114.624 -175.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -44.89 54.66 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.536 2.334 . . . . 0.0 109.301 169.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.53 -54.81 31.27 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -67.98 -34.71 77.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.998 0.399 . . . . 0.0 111.527 -176.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.96 -45.94 79.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.43 -19.46 65.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.87 -36.99 24.94 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.591 0.756 . . . . 0.0 110.85 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -60.62 148.67 81.01 Favored Pre-proline 0 CA--C 1.537 0.458 0 C-N-CA 123.368 0.667 . . . . 0.0 109.888 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -52.34 146.38 32.46 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.356 2.704 . . . . 0.0 112.939 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -33.54 49.99 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 124.051 0.834 . . . . 0.0 112.682 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -65.05 -52.87 53.36 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 117.91 0.855 . . . . 0.0 110.06 173.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.1 tptt -62.46 -32.26 73.11 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 -174.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -61.93 -58.12 9.14 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 122.955 0.502 . . . . 0.0 110.962 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -36.39 81.41 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.86 0.464 . . . . 0.0 110.273 -177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -65.16 -51.62 60.01 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 125.853 1.661 . . . . 0.0 110.978 -178.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mtp -49.96 -49.63 49.55 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.036 0.834 . . . . 0.0 111.475 175.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.8 mtpt -53.82 -48.09 70.25 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.142 0.428 . . . . 0.0 111.423 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.07 -44.76 95.99 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.819 0.448 . . . . 0.0 111.931 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -69.59 -51.7 32.8 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.879 0.871 . . . . 0.0 110.734 -169.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.22 -37.97 56.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.371 1.068 . . . . 0.0 110.758 169.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.69 -90.86 0.01 OUTLIER Glycine 0 CA--C 1.533 1.178 0 C-N-CA 124.632 1.111 . . . . 0.0 111.115 169.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -158.49 28.78 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.77 0.828 . . . . 0.0 112.683 -176.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.2 t80 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.696 1.198 . . . . 0.0 110.39 -179.88 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.038 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -61.97 -33.58 74.57 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 123.911 0.884 . . . . 0.0 112.962 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -167.89 129.56 1.47 Allowed 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 128.325 2.65 . . . . 0.0 107.542 171.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 p -49.62 154.97 0.87 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.665 1.186 . . . . 0.0 111.434 -178.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.56 -25.01 59.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.249 0.619 . . . . 0.0 111.708 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.8 -49.77 10.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.315 1.046 . . . . 0.0 111.792 174.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.12 -36.42 72.89 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.463 0.705 . . . . 0.0 110.169 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.873 ' CZ ' ' CD2' ' A' ' 11' ' ' PHE . 3.3 t80 -51.43 -57.79 8.02 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 127.642 2.377 . . . . 0.0 107.455 172.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.2 t -59.27 -31.59 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.187 0 CA-C-N 119.1 0.864 . . . . 0.0 111.217 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.88 -48.56 68.4 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.141 0.428 . . . . 0.0 110.52 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.5 t -73.8 -32.96 36.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.331 1.452 . . . . 0.0 112.072 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.873 ' CD2' ' CZ ' ' A' ' 7' ' ' PHE . 7.1 m-85 -83.65 -38.74 21.13 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 125.935 1.694 . . . . 0.0 108.296 -174.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.25 17.72 68.55 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.4 pt -150.06 143.37 17.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.93 158.97 26.68 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.3 ttt180 -52.54 -41.88 63.9 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 126.793 2.037 . . . . 0.0 110.094 169.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.83 -54.31 29.09 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 178.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -65.16 -36.49 84.4 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 117.292 0.546 . . . . 0.0 111.085 -177.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -62.15 -48.5 79.81 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.058 0.543 . . . . 0.0 109.691 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.27 65.84 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.52 -35.57 22.79 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.895 0.878 . . . . 0.0 111.297 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.26 151.96 74.24 Favored Pre-proline 0 CA--C 1.536 0.419 0 C-N-CA 123.549 0.74 . . . . 0.0 110.202 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -53.47 146.11 43.55 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.202 2.601 . . . . 0.0 112.864 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.29 -33.93 32.26 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 124.439 1.018 . . . . 0.0 112.749 177.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.68 -51.44 49.59 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 117.766 0.783 . . . . 0.0 110.979 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -61.91 -33.82 74.94 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 -178.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -61.92 -57.61 11.08 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 123.239 0.616 . . . . 0.0 110.343 177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -39.26 93.48 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.7 0.4 . . . . 0.0 110.411 -176.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -59.17 -52.9 63.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.007 0.523 . . . . 0.0 110.179 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 53.7 mmm -55.25 -44.08 75.2 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.371 0.668 . . . . 0.0 112.313 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -56.07 -51.67 67.01 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.374 0.533 . . . . 0.0 111.087 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -60.3 -45.35 93.66 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.858 0.463 . . . . 0.0 111.628 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.71 -55.27 21.01 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.347 1.059 . . . . 0.0 110.843 -173.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -58.02 -30.04 65.79 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.581 0.752 . . . . 0.0 110.46 173.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.3 -88.91 0.02 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.707 1.146 . . . . 0.0 110.28 168.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.3 36.17 0.2 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.599 0.76 . . . . 0.0 111.896 -173.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.037 -0.983 . . . . 0.0 110.106 -179.999 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.03 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -86.52 25.22 1.26 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.76 1.224 . . . . 0.0 111.655 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -175.09 130.28 0.3 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.994 2.118 . . . . 0.0 107.26 -173.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.8 m -45.39 140.85 2.88 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.351 1.461 . . . . 0.0 111.093 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -53.17 -26.28 16.58 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.752 1.221 . . . . 0.0 112.933 -170.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 -80.74 -49.39 11.22 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.843 0.857 . . . . 0.0 111.716 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.76 -39.91 62.65 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.555 1.142 . . . . 0.0 111.758 172.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -52.35 -58.23 7.34 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 128.068 2.547 . . . . 0.0 107.884 174.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.28 -32.14 47.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 118.674 0.67 . . . . 0.0 110.998 -176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 t -66.28 -45.02 81.9 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.102 0.41 . . . . 0.0 110.673 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 55.7 t -77.79 -33.45 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.235 1.414 . . . . 0.0 111.99 -177.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -84.42 -38.57 20.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.784 1.633 . . . . 0.0 108.647 -173.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.39 16.95 70.05 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.9 pt -149.58 142.61 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.13 158.78 25.0 Favored 'General case' 0 CA--C 1.516 -0.352 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.4 ttp180 -53.54 -41.01 65.98 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 126.19 1.796 . . . . 0.0 110.07 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.07 -53.62 29.0 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 178.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -62.84 -38.33 90.35 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.116 0.458 . . . . 0.0 111.012 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -62.31 -47.22 85.22 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.405 0.682 . . . . 0.0 109.875 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -19.33 65.87 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.59 -35.75 22.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.756 0.822 . . . . 0.0 111.153 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.5 mt -60.94 153.04 67.68 Favored Pre-proline 0 CA--C 1.535 0.375 0 C-N-CA 123.852 0.861 . . . . 0.0 109.967 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.55 150.31 86.75 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.627 2.218 . . . . 0.0 111.252 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.37 -34.54 26.42 Favored Glycine 0 CA--C 1.528 0.871 0 C-N-CA 124.938 1.256 . . . . 0.0 112.853 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.7 p-90 -69.03 -49.66 55.63 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 117.747 0.773 . . . . 0.0 111.115 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -61.62 -35.4 77.77 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -60.68 -58.16 9.64 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 122.819 0.448 . . . . 0.0 110.202 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.35 -39.39 92.97 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.793 0.437 . . . . 0.0 110.592 -176.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -56.34 -53.84 52.56 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 122.947 0.499 . . . . 0.0 109.836 175.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.7 mmm -56.84 -41.45 77.9 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.713 0.805 . . . . 0.0 112.246 -178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.26 -53.18 60.29 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.866 0.757 . . . . 0.0 110.838 175.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -59.76 -45.06 93.41 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.193 0.597 . . . . 0.0 111.49 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -67.23 -52.93 34.99 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.601 1.16 . . . . 0.0 110.617 -172.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -60.76 -28.56 68.81 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.093 0.557 . . . . 0.0 110.532 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.31 -89.97 0.02 OUTLIER Glycine 0 CA--C 1.531 1.056 0 C-N-CA 124.769 1.176 . . . . 0.0 110.407 169.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -165.16 29.82 0.06 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.842 0.857 . . . . 0.0 111.824 -174.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.1 t80 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 117.2 -1.381 . . . . 0.0 110.206 -177.002 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.012 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -86.75 23.99 1.57 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.614 1.166 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -174.24 130.68 0.38 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.628 1.971 . . . . 0.0 107.528 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 m -44.19 141.84 1.66 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.323 1.449 . . . . 0.0 111.032 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.85 -23.89 33.45 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.19 0.996 . . . . 0.0 113.005 -169.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -81.11 -49.96 10.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.968 0.907 . . . . 0.0 111.701 173.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.8 -33.62 66.86 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.748 1.219 . . . . 0.0 110.921 174.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -54.76 -57.1 12.87 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 127.375 2.27 . . . . 0.0 107.77 172.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -60.05 -33.13 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 118.807 0.731 . . . . 0.0 110.737 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.5 t -63.44 -48.65 76.85 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.012 0.369 . . . . 0.0 110.438 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 75.4 t -75.77 -32.94 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.584 1.154 . . . . 0.0 111.87 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.93 -24.72 28.26 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.993 1.717 . . . . 0.0 109.713 -173.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.38 28.51 20.49 Favored Glycine 0 CA--C 1.528 0.845 0 C-N-CA 124.645 1.117 . . . . 0.0 112.777 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.5 pt -144.91 141.75 23.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -66.5 159.39 27.33 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -176.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -53.95 -42.05 68.44 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 126.491 1.916 . . . . 0.0 110.19 169.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.26 -52.9 32.53 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -62.66 -40.47 97.15 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 116.972 0.386 . . . . 0.0 110.925 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -59.82 -49.34 78.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.353 0.661 . . . . 0.0 109.588 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.57 -18.93 65.32 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.05 -33.86 19.38 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.006 0.922 . . . . 0.0 111.426 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.03 154.36 69.34 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 123.801 0.841 . . . . 0.0 110.571 -177.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.22 145.75 33.85 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.291 2.661 . . . . 0.0 112.653 176.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.61 -33.82 42.11 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.063 0.839 . . . . 0.0 112.658 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -67.25 -51.39 53.69 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 117.724 0.762 . . . . 0.0 110.679 175.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.02 -32.83 73.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.4 -58.85 6.54 Favored 'General case' 0 C--N 1.34 0.168 0 O-C-N 121.952 -0.467 . . . . 0.0 110.545 176.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.15 -38.52 89.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.661 0.384 . . . . 0.0 110.608 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -57.62 -55.63 32.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.606 1.563 . . . . 0.0 110.5 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 73.8 mmm -56.88 -44.16 81.99 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.63 0.65 . . . . 0.0 111.913 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -56.41 -52.07 66.01 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.371 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.08 -43.37 92.38 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.045 0.384 . . . . 0.0 111.443 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -69.19 -46.65 66.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 123.245 0.618 . . . . 0.0 111.035 -169.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -27.55 68.54 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.307 0.243 . . . . 0.0 110.35 173.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.1 -89.86 0.04 OUTLIER Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.027 1.299 . . . . 0.0 111.392 170.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -156.16 41.8 0.38 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.356 1.462 . . . . 0.0 110.629 -170.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.8 t80 . . . . . 0 C--O 1.251 1.174 0 C-N-CA 128.927 2.891 . . . . 0.0 111.068 -178.496 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.025 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 49.8 p90 -81.84 31.22 0.37 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.95 1.3 . . . . 0.0 111.924 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -170.03 130.58 0.98 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.84 2.056 . . . . 0.0 106.525 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 m -44.94 138.11 3.77 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 124.809 1.244 . . . . 0.0 110.173 -175.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -59.06 -20.19 51.09 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -169.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -81.86 -49.27 10.54 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.873 0.869 . . . . 0.0 111.377 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.58 -37.74 65.89 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.035 1.334 . . . . 0.0 110.988 173.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -52.33 -57.47 9.67 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 127.407 2.283 . . . . 0.0 108.131 172.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -61.12 -31.58 50.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 118.359 0.527 . . . . 0.0 110.705 -176.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.0 t -64.99 -44.85 87.95 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.963 0.347 . . . . 0.0 110.658 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.1 t -79.84 -34.95 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 124.475 1.11 . . . . 0.0 111.786 -177.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -79.8 -32.72 40.79 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 125.823 1.649 . . . . 0.0 108.775 -175.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.79 15.31 75.74 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 pt -151.86 146.57 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.41 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 -175.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.22 158.2 29.47 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -53.41 -39.86 64.66 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.102 -1.863 . . . . 0.0 109.87 170.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.4 -54.28 30.48 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.177 0.894 . . . . 0.0 111.08 177.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -64.89 -36.15 83.43 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 117.511 0.656 . . . . 0.0 110.972 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.48 -48.64 80.88 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.421 0.689 . . . . 0.0 110.146 175.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.81 -19.29 65.77 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.83 -34.99 22.59 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.855 0.862 . . . . 0.0 111.351 175.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.32 153.03 61.09 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 123.59 0.756 . . . . 0.0 110.373 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.72 144.76 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 123.227 2.618 . . . . 0.0 112.735 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.54 -32.84 39.59 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.088 0.851 . . . . 0.0 112.62 177.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.6 p-90 -68.18 -50.59 53.34 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 117.766 0.783 . . . . 0.0 110.844 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.9 -35.07 75.71 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.16 -57.95 10.61 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 122.695 0.398 . . . . 0.0 110.576 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -37.22 86.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.896 0.478 . . . . 0.0 110.654 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.13 -54.58 45.13 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.113 1.365 . . . . 0.0 110.284 177.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.0 mtp -55.61 -45.52 77.5 Favored 'General case' 0 C--N 1.34 0.163 0 CA-C-N 118.16 0.436 . . . . 0.0 111.603 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.36 -49.14 78.28 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 119.274 -0.394 . . . . 0.0 111.625 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -70.62 -29.24 65.57 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.538 0.608 . . . . 0.0 111.974 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -68.63 -50.6 50.08 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.937 0.895 . . . . 0.0 110.646 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -58.04 -29.3 65.25 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 122.613 0.365 . . . . 0.0 110.778 169.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.74 -91.83 0.02 OUTLIER Glycine 0 CA--C 1.53 1.03 0 C-N-CA 124.387 0.994 . . . . 0.0 110.621 169.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -166.14 24.85 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.417 0.687 . . . . 0.0 112.424 -175.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.7 t80 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 117.441 -1.266 . . . . 0.0 109.436 -175.17 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.015 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -152.55 111.67 3.84 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.958 0.903 . . . . 0.0 108.75 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.0 mp 52.88 85.61 0.05 OUTLIER 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.647 1.579 . . . . 0.0 112.943 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 p -68.15 149.63 49.34 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 168.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.02 -25.28 60.93 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 122.306 0.242 . . . . 0.0 111.514 -174.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 -81.49 -50.76 9.03 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.233 1.013 . . . . 0.0 112.505 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.38 -37.03 76.91 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 118.664 0.665 . . . . 0.0 111.487 176.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -47.69 -57.53 5.41 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 126.795 2.038 . . . . 0.0 107.929 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.2 t -60.3 -31.36 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 CA-C-N 119.184 0.902 . . . . 0.0 111.101 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 t -67.25 -45.73 75.84 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.157 0.435 . . . . 0.0 110.547 178.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.2 t -75.87 -33.69 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.257 1.423 . . . . 0.0 111.755 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -82.74 -38.23 23.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.425 1.49 . . . . 0.0 108.583 -173.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.28 18.23 67.28 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.0 pt -150.4 143.28 17.28 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.37 159.52 26.7 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -175.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -53.6 -41.29 66.47 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 125.832 1.653 . . . . 0.0 110.15 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.49 -53.84 29.73 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.58 -39.39 93.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 117.025 0.412 . . . . 0.0 110.924 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -61.31 -48.93 79.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.647 0.779 . . . . 0.0 109.834 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.91 -19.4 65.91 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.15 -34.78 22.04 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.874 0.869 . . . . 0.0 111.362 175.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -60.98 152.64 69.78 Favored Pre-proline 0 CA--C 1.537 0.472 0 C-N-CA 123.685 0.794 . . . . 0.0 110.283 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -52.36 144.69 39.03 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.272 2.648 . . . . 0.0 112.588 177.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.81 -32.74 41.33 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 123.989 0.804 . . . . 0.0 112.67 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.87 -50.83 54.2 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 117.68 0.74 . . . . 0.0 110.764 174.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -62.0 -32.62 73.11 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -177.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -61.44 -56.65 17.85 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 122.921 0.488 . . . . 0.0 110.571 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.43 -39.66 94.26 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.431 0.292 . . . . 0.0 110.615 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -51.4 64.36 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 125.254 1.422 . . . . 0.0 109.814 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 60.7 mmm -61.94 -44.0 97.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.65 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -54.86 -52.25 63.4 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.644 0.656 . . . . 0.0 111.121 176.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.77 -48.55 80.83 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 111.652 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 -65.67 -53.91 34.78 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 111.023 -173.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -58.05 -31.04 66.65 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.355 0.525 . . . . 0.0 110.771 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.72 -89.42 0.02 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.76 1.172 . . . . 0.0 110.94 169.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -93.43 42.35 1.1 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.961 1.304 . . . . 0.0 112.707 -170.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.3 p90 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 124.632 1.173 . . . . 0.0 113.084 169.813 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.06 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 14.0 t80 59.73 -154.06 0.37 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.864 1.266 . . . . 0.0 110.431 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -164.83 127.97 2.34 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.701 1.6 . . . . 0.0 107.795 -175.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.4 m -50.35 148.4 3.67 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.282 1.433 . . . . 0.0 110.548 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 64.9 mm-40 -60.43 -16.11 32.96 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -174.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 mp0 -80.45 -50.61 9.84 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.18 0.992 . . . . 0.0 111.426 170.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.51 -33.69 73.0 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.457 1.103 . . . . 0.0 110.733 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -53.31 -52.96 57.44 Favored 'General case' 0 C--O 1.217 -0.646 0 C-N-CA 128.98 2.912 . . . . 0.0 108.141 171.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 8.0 t -57.21 -32.92 41.94 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 119.382 0.992 . . . . 0.0 111.049 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.2 t -68.55 -24.11 64.59 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.6 t -105.22 -32.54 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.889 1.675 . . . . 0.0 111.425 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -86.06 -38.82 17.42 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.94 2.096 . . . . 0.0 108.738 -175.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.89 11.59 82.47 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.075 -0.847 . . . . 0.0 111.155 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.3 pt -142.46 142.12 27.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 118.013 0.907 . . . . 0.0 109.45 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.99 157.92 29.59 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.99 0.9 . . . . 0.0 113.083 -176.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -52.69 -40.11 62.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 126.587 1.955 . . . . 0.0 110.063 170.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.25 -55.16 27.63 Favored Glycine 0 CA--C 1.528 0.855 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -66.28 -37.66 85.95 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 117.288 0.544 . . . . 0.0 110.701 -177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -60.38 -48.94 79.6 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.618 0.767 . . . . 0.0 109.923 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.03 -19.27 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.59 -34.69 21.38 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.891 0.876 . . . . 0.0 111.317 175.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.6 mt -61.31 152.67 71.92 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.817 0.847 . . . . 0.0 110.249 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -51.79 144.98 32.96 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.322 2.682 . . . . 0.0 112.623 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.94 -33.28 43.43 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 123.944 0.783 . . . . 0.0 112.58 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.4 p-90 -68.59 -48.95 62.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 117.742 0.771 . . . . 0.0 110.752 175.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -62.03 -32.98 73.53 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.29 -57.67 10.53 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 123.062 0.545 . . . . 0.0 110.533 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.71 -38.83 92.58 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.57 0.348 . . . . 0.0 110.733 -177.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -51.67 -57.13 10.07 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.283 1.433 . . . . 0.0 109.43 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 69.2 mmm -59.31 -47.05 86.87 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 111.694 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -54.19 -50.18 67.65 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 118.466 0.575 . . . . 0.0 111.525 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -60.67 -54.46 45.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.527 0.331 . . . . 0.0 111.273 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -60.7 -47.14 87.59 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.948 1.299 . . . . 0.0 112.107 -169.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -29.79 69.36 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.674 0.39 . . . . 0.0 110.555 175.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.93 -89.72 0.06 OUTLIER Glycine 0 CA--C 1.532 1.107 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -158.0 24.91 0.26 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.92 1.288 . . . . 0.0 111.055 -177.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 125.914 1.686 . . . . 0.0 109.925 -169.523 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.008 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -86.35 23.12 1.65 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.547 1.139 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -172.29 129.96 0.59 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.556 1.942 . . . . 0.0 107.554 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.6 p -49.57 148.76 2.68 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.737 0.815 . . . . 0.0 110.447 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -62.02 -15.53 44.98 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -81.64 -50.71 9.0 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.43 1.092 . . . . 0.0 111.774 169.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -57.26 -34.75 68.95 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.717 0.807 . . . . 0.0 110.161 175.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -53.33 -58.52 6.82 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 127.908 2.483 . . . . 0.0 107.91 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.7 t -53.84 -32.47 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 118.733 0.697 . . . . 0.0 111.826 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -66.77 -45.53 78.21 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.495 0.589 . . . . 0.0 110.914 177.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 78.8 t -80.86 -32.8 12.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 125.464 1.506 . . . . 0.0 112.342 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -88.93 -38.09 14.76 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 126.881 2.073 . . . . 0.0 108.862 -173.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.2 8.52 86.33 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.907 -0.941 . . . . 0.0 111.258 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.5 pt -141.95 142.75 27.67 Favored 'Isoleucine or valine' 0 C--N 1.343 0.323 0 CA-C-N 118.153 0.977 . . . . 0.0 110.493 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.45 160.22 25.39 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 125.268 1.427 . . . . 0.0 113.933 -174.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -51.08 -44.08 61.14 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.801 2.041 . . . . 0.0 109.052 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -53.56 32.16 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -64.0 -37.65 88.21 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.902 0.351 . . . . 0.0 110.995 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -66.69 -45.9 77.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.31 -19.5 65.98 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.18 -36.71 24.47 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.647 0.779 . . . . 0.0 111.01 174.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.28 148.8 84.61 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 123.356 0.662 . . . . 0.0 110.043 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.48 145.22 47.68 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.275 2.65 . . . . 0.0 112.96 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.68 -33.03 33.56 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.296 0.951 . . . . 0.0 112.961 177.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 13.3 p-90 -68.2 -49.89 57.83 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 117.811 0.806 . . . . 0.0 111.025 176.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -60.54 -37.51 81.46 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -59.6 -58.28 9.29 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.556 0.342 . . . . 0.0 110.182 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.83 -38.11 86.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.779 0.432 . . . . 0.0 110.633 -175.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -59.9 -51.58 69.11 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.075 0.55 . . . . 0.0 110.611 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 86.5 mtp -54.62 -42.09 70.78 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.305 176.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.57 -52.58 64.26 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.012 0.823 . . . . 0.0 111.226 178.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -68.53 -32.49 72.47 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.36 -54.67 8.77 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.885 0.874 . . . . 0.0 110.75 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -59.87 -28.56 67.64 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.134 0.573 . . . . 0.0 110.058 172.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.89 -90.12 0.01 OUTLIER Glycine 0 CA--C 1.528 0.906 0 C-N-CA 125.413 1.483 . . . . 0.0 110.607 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.47 27.97 0.11 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -173.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.3 t80 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.134 -1.412 . . . . 0.0 109.793 179.359 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.133 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -57.99 114.74 2.48 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.876 0.87 . . . . 0.0 109.698 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.1 mp 51.0 69.46 0.64 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.106 1.363 . . . . 0.0 110.812 -174.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 74.8 m -60.76 134.62 57.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 168.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -46.94 -33.27 4.46 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.209 1.404 . . . . 0.0 112.695 -169.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.6 mp0 -79.57 -46.35 17.47 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.314 0.646 . . . . 0.0 112.108 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.59 -40.96 80.22 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.762 0.825 . . . . 0.0 111.13 173.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.648 ' HZ ' ' CD1' ' A' ' 18' ' ' PHE . 3.3 t80 -53.1 -58.01 8.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 C-N-CA 126.982 2.113 . . . . 0.0 107.822 171.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.3 t -58.1 -34.65 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 119.574 1.079 . . . . 0.0 111.673 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.7 t -64.4 -42.27 96.19 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.511 0.596 . . . . 0.0 111.235 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t -80.94 -35.83 14.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 124.9 1.28 . . . . 0.0 111.431 -176.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -84.0 -45.14 13.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.188 1.395 . . . . 0.0 109.693 -172.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.5 15.18 76.77 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.816 -0.991 . . . . 0.0 111.03 -173.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.1 pt -110.46 -160.08 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.403 0 CA-C-N 118.301 1.051 . . . . 0.0 108.305 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -122.65 158.13 30.7 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 125.217 1.407 . . . . 0.0 112.853 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 -55.14 -39.09 69.06 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 113.12 -1.854 . . . . 0.0 110.56 170.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.99 -55.35 28.67 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 178.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.9 -42.46 99.79 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-N 117.053 0.427 . . . . 0.0 110.705 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.648 ' CD1' ' HZ ' ' A' ' 7' ' ' PHE . 46.8 t80 -57.02 -45.62 82.95 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.042 0.937 . . . . 0.0 111.043 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.43 -19.08 65.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.07 -28.27 22.65 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.927 0.891 . . . . 0.0 111.431 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.06 144.93 90.33 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 177.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -54.07 143.81 60.67 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.298 1.998 . . . . 0.0 111.662 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.19 -32.13 50.28 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 123.384 0.516 . . . . 0.0 112.559 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -65.93 -50.5 64.19 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 117.644 0.722 . . . . 0.0 110.676 174.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -60.88 -35.11 75.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.623 -1.251 . . . . 0.0 107.623 -178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -62.07 -54.53 40.14 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.869 0.468 . . . . 0.0 110.546 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.21 -40.58 96.36 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.044 0.538 . . . . 0.0 110.67 -177.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -53.64 56.07 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.777 1.231 . . . . 0.0 110.544 177.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.1 mmm -59.28 -43.59 92.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.027 0.531 . . . . 0.0 111.233 -177.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -57.36 -49.9 74.7 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 119.21 -0.424 . . . . 0.0 111.21 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -70.95 -28.9 64.81 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.424 0.557 . . . . 0.0 112.414 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.72 -51.37 59.84 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 123.64 0.776 . . . . 0.0 110.167 175.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -58.36 -28.72 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.762 0.425 . . . . 0.0 110.545 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.53 -91.16 0.02 OUTLIER Glycine 0 CA--C 1.53 1.031 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 169.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -164.47 24.53 0.07 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.547 0.739 . . . . 0.0 112.359 -176.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 117.007 -1.473 . . . . 0.0 110.605 -178.857 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.029 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -86.88 25.06 1.36 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.594 1.157 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -174.7 130.08 0.33 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.254 2.222 . . . . 0.0 106.895 -173.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m -47.41 137.69 8.33 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 124.755 1.222 . . . . 0.0 110.087 -177.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -60.04 -16.7 33.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.9 mp0 -80.62 -49.13 11.67 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.495 0.718 . . . . 0.0 111.043 170.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.5 -32.91 69.25 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.979 1.312 . . . . 0.0 111.197 173.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -59.0 -53.62 56.39 Favored 'General case' 0 CA--C 1.508 -0.646 0 C-N-CA 128.461 2.704 . . . . 0.0 108.204 176.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.5 t -53.68 -33.94 23.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.802 0.728 . . . . 0.0 111.476 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.4 t -65.94 -32.22 73.59 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.3 t -97.21 -32.68 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.646 1.578 . . . . 0.0 111.511 -174.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -87.17 -41.0 14.09 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.06 1.744 . . . . 0.0 109.179 -173.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.46 9.31 85.02 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 119.026 -0.874 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 36.9 pt -139.41 144.13 29.58 Favored 'Isoleucine or valine' 0 C--N 1.344 0.357 0 CA-C-N 118.094 0.947 . . . . 0.0 110.053 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.07 158.97 27.07 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.31 1.052 . . . . 0.0 113.485 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -52.19 -40.76 61.95 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 127.211 2.205 . . . . 0.0 110.032 169.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.88 -54.37 31.28 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.217 0.913 . . . . 0.0 111.142 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -59.03 -46.02 89.26 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 117.229 0.514 . . . . 0.0 110.782 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -61.67 -46.69 88.67 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.052 0.541 . . . . 0.0 110.405 -176.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.06 -19.32 65.81 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 178.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.12 -34.87 20.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.893 0.877 . . . . 0.0 111.22 176.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.1 mt -61.36 150.4 80.26 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 123.763 0.825 . . . . 0.0 109.907 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -52.0 144.86 35.23 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 123.329 2.686 . . . . 0.0 112.622 177.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.19 -33.02 44.67 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.882 0.753 . . . . 0.0 112.71 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 p-90 -67.77 -50.38 57.42 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.61 0.705 . . . . 0.0 110.673 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -62.15 -33.09 73.84 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.79 -57.82 11.05 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 122.98 0.512 . . . . 0.0 110.392 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.36 -38.56 91.63 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.55 0.34 . . . . 0.0 110.848 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.52 -54.63 38.49 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.248 1.419 . . . . 0.0 109.908 174.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -59.53 -41.7 90.6 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-O 118.788 -0.625 . . . . 0.0 112.268 178.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -57.33 -50.72 72.03 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.953 0.797 . . . . 0.0 111.019 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.72 -44.25 93.82 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.863 0.465 . . . . 0.0 112.001 176.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -67.39 -54.14 23.1 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.842 0.857 . . . . 0.0 111.539 -174.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -57.68 -28.7 64.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.605 0.762 . . . . 0.0 110.448 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.66 -91.32 0.02 OUTLIER Glycine 0 CA--C 1.531 1.063 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 169.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -166.72 26.96 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.945 0.898 . . . . 0.0 112.248 -176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.6 t80 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.822 -176.193 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.005 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.51 176.17 5.65 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.584 0.753 . . . . 0.0 111.887 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.0 mp 55.25 85.19 0.07 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 84.4 p -64.77 146.72 54.42 Favored 'General case' 0 C--N 1.34 0.164 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -55.34 -28.38 53.4 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.571 0.748 . . . . 0.0 111.605 -173.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -80.93 -48.2 12.65 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.96 0.904 . . . . 0.0 112.467 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.22 -38.42 83.31 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.542 0.61 . . . . 0.0 111.51 174.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -49.56 -59.75 3.48 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 126.675 1.99 . . . . 0.0 107.472 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -54.23 -37.78 37.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 119.284 0.947 . . . . 0.0 112.653 177.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.7 t -64.09 -41.43 97.29 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.238 0.472 . . . . 0.0 111.453 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.4 t -83.57 -31.54 8.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.82 1.648 . . . . 0.0 111.509 -176.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -84.74 -38.82 19.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 124.863 1.265 . . . . 0.0 108.907 -170.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.04 24.04 55.94 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.2 pp -133.71 -169.83 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.208 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.06 158.21 20.62 Favored 'General case' 0 CA--C 1.513 -0.464 0 C-N-CA 124.609 1.164 . . . . 0.0 112.569 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -51.58 -39.49 57.97 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 113.365 -1.743 . . . . 0.0 110.097 170.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.31 -54.39 27.13 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 179.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.08 -45.34 87.29 Favored 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 123.038 0.535 . . . . 0.0 110.74 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -59.3 -46.8 87.59 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.619 0.768 . . . . 0.0 110.435 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.52 -18.65 65.48 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.42 -33.96 16.64 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.907 . . . . 0.0 111.225 175.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -63.07 151.2 86.83 Favored Pre-proline 0 CA--C 1.536 0.434 0 C-N-CA 123.614 0.766 . . . . 0.0 110.034 -177.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.58 144.47 41.76 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.194 2.596 . . . . 0.0 112.564 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.41 -31.92 44.1 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.001 0.81 . . . . 0.0 112.628 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 10.0 p-90 -68.28 -50.39 53.96 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.771 0.786 . . . . 0.0 110.635 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -61.96 -33.14 73.74 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -177.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -61.03 -57.52 12.25 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 123.023 0.529 . . . . 0.0 110.319 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.56 -37.65 88.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.79 0.436 . . . . 0.0 110.926 -176.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -53.98 47.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.243 1.417 . . . . 0.0 109.543 174.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 62.0 mtm -62.33 -40.05 95.09 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.197 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.53 -52.25 65.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.899 0.772 . . . . 0.0 111.062 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -58.17 -47.46 83.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 175.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -66.2 -52.69 45.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.285 0.634 . . . . 0.0 111.105 -169.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -60.81 -32.2 71.57 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.315 0.646 . . . . 0.0 110.309 174.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.3 -89.17 0.02 OUTLIER Glycine 0 CA--C 1.532 1.104 0 C-N-CA 124.909 1.243 . . . . 0.0 111.746 170.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.79 42.35 0.21 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.069 1.348 . . . . 0.0 110.325 -169.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 45.4 t80 . . . . . 0 C--O 1.252 1.217 0 C-N-CA 129.172 2.989 . . . . 0.0 111.006 -177.888 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.021 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -65.95 107.36 1.83 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.618 0.767 . . . . 0.0 109.582 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.8 mp 59.28 94.41 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.817 1.647 . . . . 0.0 111.805 178.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.4 p -58.78 147.29 33.9 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -58.49 -25.32 62.22 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -79.33 -48.54 13.91 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.21 0.604 . . . . 0.0 111.188 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.23 -38.61 77.19 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.407 0.683 . . . . 0.0 109.611 175.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.416 ' CE2' ' CD2' ' A' ' 11' ' ' PHE . 9.0 t80 -57.62 -61.11 2.74 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 126.855 2.062 . . . . 0.0 107.479 173.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.2 t -50.55 -38.13 16.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 120.09 1.314 . . . . 0.0 112.138 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 t -60.82 -35.09 75.63 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 53.7 t -99.06 -33.06 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 125.949 1.699 . . . . 0.0 111.99 -173.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.416 ' CD2' ' CE2' ' A' ' 7' ' ' PHE . 12.8 m-85 -90.83 -39.05 12.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.559 1.943 . . . . 0.0 109.355 -169.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.44 6.15 89.43 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 118.545 -1.141 . . . . 0.0 111.399 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.6 pt -123.6 140.86 45.87 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 CA-C-N 118.343 1.071 . . . . 0.0 110.348 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.3 159.06 30.04 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.72 1.208 . . . . 0.0 113.455 -175.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -53.79 -39.74 65.7 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 126.575 1.95 . . . . 0.0 110.451 169.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.09 -54.88 32.98 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 124.173 0.892 . . . . 0.0 110.9 176.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -65.3 -40.31 93.64 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 117.468 0.634 . . . . 0.0 110.82 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -57.21 -48.96 77.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.678 0.791 . . . . 0.0 110.798 174.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.81 -19.69 65.79 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.33 -35.61 25.07 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.618 0.767 . . . . 0.0 111.0 174.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.96 147.39 90.07 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.73 145.23 50.38 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.725 2.283 . . . . 0.0 112.66 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.88 -33.04 35.08 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.165 0.888 . . . . 0.0 112.725 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -67.71 -50.63 56.51 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 117.672 0.736 . . . . 0.0 110.975 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.9 tptp -62.22 -34.2 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -61.36 -58.3 8.77 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.503 0.721 . . . . 0.0 110.183 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.67 -38.79 91.72 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.37 0.668 . . . . 0.0 110.62 -175.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -59.31 -55.0 40.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.803 0.441 . . . . 0.0 109.999 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.6 mmm -56.19 -42.9 77.87 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.79 0.836 . . . . 0.0 112.4 -177.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -54.27 -55.11 31.46 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.578 0.351 . . . . 0.0 110.896 174.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -63.92 -33.64 76.17 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.776 0.83 . . . . 0.0 112.925 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -65.99 -48.19 72.02 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 124.19 0.996 . . . . 0.0 111.274 -175.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -58.79 -29.09 66.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.255 0.48 . . . . 0.0 111.263 170.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.88 -91.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.958 0 N-CA-C 109.754 -1.338 . . . . 0.0 109.754 169.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -167.35 24.64 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.712 0.805 . . . . 0.0 112.087 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.041 -0.981 . . . . 0.0 109.496 -172.836 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.02 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -69.5 105.02 2.49 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.49 0.716 . . . . 0.0 109.476 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.4 mp 58.96 93.03 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.563 1.545 . . . . 0.0 112.714 172.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.0 p -64.88 140.62 58.89 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 169.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -59.77 -19.65 51.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -169.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -79.81 -47.78 14.62 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.504 0.722 . . . . 0.0 111.3 175.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -40.22 93.34 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.687 0.795 . . . . 0.0 109.714 175.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -50.58 -62.0 1.86 Allowed 'General case' 0 C--O 1.216 -0.684 0 C-N-CA 127.727 2.411 . . . . 0.0 107.397 170.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.1 t -50.95 -39.16 18.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.577 1.081 . . . . 0.0 112.201 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -65.03 -31.34 72.52 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.9 t -101.11 -27.72 3.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 125.818 1.647 . . . . 0.0 111.545 -173.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -85.2 -45.62 11.85 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.47 1.908 . . . . 0.0 108.393 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.75 13.32 80.05 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -175.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.07 141.86 37.22 Favored 'Isoleucine or valine' 0 C--N 1.345 0.411 0 CA-C-N 118.132 0.966 . . . . 0.0 109.929 178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.72 161.91 27.29 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 124.901 1.28 . . . . 0.0 113.358 -177.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -56.36 -41.75 76.66 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.564 1.946 . . . . 0.0 108.134 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.45 -53.43 28.7 Favored Glycine 0 C--N 1.339 0.734 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -63.24 -38.78 92.51 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.515 0.326 . . . . 0.0 110.943 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.55 -48.15 80.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.941 0.496 . . . . 0.0 109.673 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.84 -19.67 65.99 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.88 -35.71 23.93 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.851 0.86 . . . . 0.0 111.123 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -61.2 151.51 75.63 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.588 0.755 . . . . 0.0 109.902 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -53.53 145.77 45.72 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 123.124 2.55 . . . . 0.0 112.939 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.11 -33.64 30.42 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 124.465 1.031 . . . . 0.0 112.853 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.2 p-90 -68.44 -50.65 51.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 117.658 0.729 . . . . 0.0 111.049 176.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 tptt -61.75 -34.63 76.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -179.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -61.33 -57.51 12.02 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.253 0.621 . . . . 0.0 110.395 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.86 -39.81 95.55 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.059 -176.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.27 -54.67 44.11 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.975 0.51 . . . . 0.0 110.028 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 55.9 mmm -54.49 -44.41 72.65 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 123.275 0.63 . . . . 0.0 112.153 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -56.24 -50.47 71.2 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.115 0.416 . . . . 0.0 111.779 176.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -63.05 -45.0 94.31 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 118.169 0.441 . . . . 0.0 111.973 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -68.08 -49.39 61.6 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.7 0.8 . . . . 0.0 111.399 -169.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -64.12 -29.68 70.8 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.23 0.212 . . . . 0.0 110.479 173.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.61 -89.66 0.02 OUTLIER Glycine 0 CA--C 1.532 1.131 0 C-N-CA 124.869 1.223 . . . . 0.0 111.614 169.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.87 41.23 0.28 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.296 1.438 . . . . 0.0 110.562 -169.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 39.4 t80 . . . . . 0 C--O 1.25 1.105 0 C-N-CA 128.633 2.773 . . . . 0.0 110.917 -177.344 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.033 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.3 p90 -86.94 24.31 1.54 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.606 1.163 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -174.21 129.81 0.37 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 127.02 2.128 . . . . 0.0 106.963 -173.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 94.6 p -51.06 148.55 4.29 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.962 0.905 . . . . 0.0 110.89 -176.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -53.75 -27.55 29.3 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.603 1.561 . . . . 0.0 112.008 -172.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 mp0 -80.01 -50.02 10.98 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.985 0.914 . . . . 0.0 112.156 176.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.31 -38.58 74.25 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.915 0.864 . . . . 0.0 111.588 173.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -51.26 -57.29 9.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 128.229 2.611 . . . . 0.0 107.761 172.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.8 t -53.69 -33.45 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 119.124 0.875 . . . . 0.0 112.184 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -67.81 -42.68 81.19 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.543 0.61 . . . . 0.0 111.164 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 66.2 t -82.13 -31.59 10.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 125.527 1.531 . . . . 0.0 112.229 -175.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -89.15 -40.85 12.62 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.457 1.903 . . . . 0.0 108.733 -173.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.49 10.39 83.5 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 118.997 -0.891 . . . . 0.0 111.092 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.9 pt -141.85 144.61 25.31 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 118.153 0.977 . . . . 0.0 110.149 -178.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.12 159.75 25.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 124.852 1.261 . . . . 0.0 113.73 -175.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -53.08 -42.14 65.6 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 113.045 -1.888 . . . . 0.0 109.267 169.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.74 -54.79 28.81 Favored Glycine 0 C--N 1.339 0.719 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -65.71 -36.4 83.51 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 117.243 0.522 . . . . 0.0 110.957 -177.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -63.1 -47.72 81.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.801 0.441 . . . . 0.0 110.226 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.46 -19.6 66.0 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 177.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.39 -36.72 24.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.681 0.793 . . . . 0.0 111.039 175.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.1 mt -61.16 148.43 84.8 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.594 0.757 . . . . 0.0 109.621 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -52.92 145.94 38.71 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.207 2.604 . . . . 0.0 112.88 177.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.81 -33.66 35.68 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.301 0.953 . . . . 0.0 112.781 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -68.44 -49.73 57.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.762 0.781 . . . . 0.0 110.982 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -61.01 -36.92 80.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -59.52 -58.0 10.49 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 122.98 0.512 . . . . 0.0 110.119 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -38.2 88.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.911 0.484 . . . . 0.0 110.501 -175.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -58.43 -52.79 64.16 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 119.177 -0.439 . . . . 0.0 110.32 176.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.3 mtp -54.59 -41.06 69.47 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.293 -0.86 . . . . 0.0 112.706 177.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -55.55 -53.59 54.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.296 0.953 . . . . 0.0 110.669 176.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -58.82 -47.81 83.51 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.268 0.627 . . . . 0.0 111.591 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -64.8 -52.68 55.55 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.25 1.42 . . . . 0.0 111.129 -172.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -58.94 -28.14 65.98 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.236 0.614 . . . . 0.0 110.582 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.95 -90.98 0.03 OUTLIER Glycine 0 CA--C 1.529 0.948 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 168.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -170.55 27.76 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.538 1.135 . . . . 0.0 111.742 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 116.546 -1.692 . . . . 0.0 108.251 -173.356 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.022 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.8 -173.81 1.97 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.71 0.804 . . . . 0.0 111.911 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.4 mp 55.08 78.22 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.908 1.283 . . . . 0.0 111.222 -175.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 67.6 m -57.45 138.03 55.52 Favored 'General case' 0 C--O 1.226 -0.177 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 169.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -58.19 -22.97 53.84 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -169.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -79.16 -48.49 14.16 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.01 0.924 . . . . 0.0 111.758 174.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.2 -38.84 77.53 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.884 0.874 . . . . 0.0 109.878 174.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -55.38 -58.08 9.19 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 126.964 2.106 . . . . 0.0 107.845 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' ' 13' ' ' ILE . 3.5 t -53.17 -36.13 24.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 120.4 1.455 . . . . 0.0 111.693 177.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.2 t -65.02 -39.38 93.3 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 118.558 0.617 . . . . 0.0 111.646 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.7 t -84.83 -32.82 7.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.539 1.536 . . . . 0.0 111.81 -176.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -93.35 -49.52 5.9 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.404 1.881 . . . . 0.0 109.75 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.29 9.56 84.84 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.304 -1.275 . . . . 0.0 111.228 -170.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.401 ' O ' HG22 ' A' ' 8' ' ' VAL . 3.2 pt -117.63 140.96 38.6 Favored 'Isoleucine or valine' 0 C--N 1.348 0.528 0 CA-C-N 118.814 1.307 . . . . 0.0 110.286 175.385 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.97 158.3 34.98 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.769 1.228 . . . . 0.0 113.649 -175.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -52.88 -39.96 63.09 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 127.496 2.318 . . . . 0.0 110.307 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.51 -52.85 48.43 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 176.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -65.02 -43.13 93.44 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-N 117.653 0.727 . . . . 0.0 110.737 -177.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -55.07 -48.32 73.66 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.021 0.529 . . . . 0.0 111.324 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.29 -19.54 65.5 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.22 -34.19 23.95 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.798 0.839 . . . . 0.0 111.102 174.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 mt -61.61 144.59 92.57 Favored Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -53.42 145.22 46.97 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.813 2.342 . . . . 0.0 112.487 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.02 -33.49 36.93 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.989 0.804 . . . . 0.0 112.824 178.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.39 -49.44 63.85 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 117.562 0.681 . . . . 0.0 110.921 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -60.75 -37.98 83.64 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -59.35 -55.91 28.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.12 0.568 . . . . 0.0 110.414 -179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.08 -37.14 86.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.095 0.558 . . . . 0.0 110.391 -176.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -62.72 -51.94 65.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.137 -0.459 . . . . 0.0 110.415 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 68.4 mtp -54.72 -45.45 74.06 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 118.711 0.687 . . . . 0.0 112.735 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -51.04 -55.28 18.28 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.05 0.54 . . . . 0.0 110.242 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -66.09 -36.67 83.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.782 0.833 . . . . 0.0 112.68 -178.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -66.77 -45.43 78.55 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.475 1.11 . . . . 0.0 110.842 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -58.91 -28.01 65.8 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.804 0.275 . . . . 0.0 110.876 171.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -68.64 -92.31 0.06 OUTLIER Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -166.37 28.98 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 112.045 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.88 -177.816 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.013 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -88.1 -117.56 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.92 0.888 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 tp -161.15 117.53 2.22 Favored 'General case' 0 N--CA 1.437 -1.101 0 N-CA-C 103.454 -2.795 . . . . 0.0 103.454 -168.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.9 m -53.24 139.64 28.8 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.411 1.084 . . . . 0.0 111.032 -169.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -30.31 19.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.874 1.269 . . . . 0.0 113.451 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 -84.0 -45.14 13.44 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 175.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -55.01 -37.29 66.44 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.986 0.914 . . . . 0.0 110.457 173.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -53.27 -58.4 7.21 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 127.338 2.255 . . . . 0.0 107.287 170.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.4 t -58.72 -32.89 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 119.284 0.947 . . . . 0.0 111.133 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.6 t -65.64 -48.1 73.34 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.056 0.389 . . . . 0.0 110.632 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.5 t -75.0 -32.71 27.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 125.155 1.382 . . . . 0.0 111.854 -177.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -83.06 -38.02 23.08 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.971 1.709 . . . . 0.0 108.409 -174.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.66 17.04 69.13 Favored Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 pt -150.8 142.11 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.35 160.91 23.64 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -176.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -52.9 -39.7 62.95 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 113.624 -1.625 . . . . 0.0 109.86 169.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.26 -55.52 23.18 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -58.51 -45.22 89.2 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.745 0.418 . . . . 0.0 110.967 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -60.43 -48.16 82.98 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.779 0.832 . . . . 0.0 110.245 -178.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.86 -19.52 65.91 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 178.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.81 -34.76 22.66 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.728 0.811 . . . . 0.0 111.194 175.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.68 150.78 80.71 Favored Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 123.566 0.746 . . . . 0.0 109.812 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -53.31 145.82 43.18 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.082 2.521 . . . . 0.0 112.876 177.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.43 -33.44 32.46 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.373 0.987 . . . . 0.0 112.751 177.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -67.99 -51.02 52.07 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 117.645 0.723 . . . . 0.0 110.999 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.6 tptt -61.95 -34.07 75.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -61.46 -57.55 11.72 Favored 'General case' 0 C--N 1.343 0.31 0 C-N-CA 123.302 0.641 . . . . 0.0 110.36 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -39.46 94.17 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 122.651 0.38 . . . . 0.0 110.335 -176.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -59.25 -52.04 67.39 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.086 0.554 . . . . 0.0 110.341 176.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 51.7 mmm -54.99 -44.23 74.3 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.352 0.661 . . . . 0.0 112.208 178.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mtpm? -56.32 -51.03 69.74 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.395 0.543 . . . . 0.0 110.885 177.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -59.92 -44.51 94.26 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.015 0.526 . . . . 0.0 111.924 176.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -67.32 -52.79 36.1 Favored 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 124.538 1.135 . . . . 0.0 111.002 -171.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.69 -29.73 64.91 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.605 0.762 . . . . 0.0 110.509 172.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.3 -90.05 0.02 OUTLIER Glycine 0 CA--C 1.533 1.2 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -160.16 29.28 0.17 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.853 0.861 . . . . 0.0 112.267 -176.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 36.5 t80 . . . . . 0 C--O 1.252 1.198 0 C-N-CA 124.662 1.185 . . . . 0.0 110.501 -178.75 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.007 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -154.78 -160.46 1.07 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.064 0.945 . . . . 0.0 108.846 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -163.96 127.91 2.69 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.6 1.56 . . . . 0.0 107.934 -171.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.1 m -51.22 144.67 9.1 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 125.584 1.554 . . . . 0.0 110.33 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.3 mm-40 -57.36 -20.31 28.45 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -172.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -79.9 -48.02 14.13 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.39 0.676 . . . . 0.0 111.172 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.75 -39.37 80.73 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 111.714 173.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -53.37 -53.65 48.1 Favored 'General case' 0 C--O 1.215 -0.757 0 C-N-CA 129.135 2.974 . . . . 0.0 107.837 174.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 t -54.2 -31.97 22.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.162 0.892 . . . . 0.0 111.955 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.1 t -67.45 -43.9 79.97 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.321 0.51 . . . . 0.0 110.969 176.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.48 -32.95 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 125.85 1.66 . . . . 0.0 112.389 -174.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -88.48 -41.26 12.86 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 126.768 2.027 . . . . 0.0 108.888 -172.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.55 11.5 81.78 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-O 119.085 -0.842 . . . . 0.0 111.104 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.6 pt -142.64 142.55 26.59 Favored 'Isoleucine or valine' 0 C--N 1.343 0.308 0 CA-C-N 117.945 0.873 . . . . 0.0 109.78 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.38 158.93 22.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 124.321 1.049 . . . . 0.0 113.58 -175.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -54.33 -41.68 69.33 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 126.201 1.8 . . . . 0.0 110.164 169.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.14 -53.74 31.57 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 177.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -63.29 -39.57 94.95 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 117.264 0.532 . . . . 0.0 110.967 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -63.02 -48.18 79.9 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.334 0.654 . . . . 0.0 109.837 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.17 -19.53 66.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.44 0.534 . . . . 0.0 112.44 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.53 -35.7 22.69 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.787 0.835 . . . . 0.0 111.228 175.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.2 mt -61.07 150.37 78.92 Favored Pre-proline 0 CA--C 1.535 0.384 0 C-N-CA 123.618 0.767 . . . . 0.0 109.774 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.03 145.44 41.75 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.221 2.614 . . . . 0.0 112.803 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.52 -33.3 32.9 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.275 0.94 . . . . 0.0 112.804 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -67.64 -51.19 52.89 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.716 0.758 . . . . 0.0 110.97 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -62.01 -34.03 75.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -61.5 -58.6 7.5 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.024 0.529 . . . . 0.0 110.05 177.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.23 -38.69 90.19 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 122.985 0.514 . . . . 0.0 110.465 -175.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -51.07 71.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 122.88 0.472 . . . . 0.0 110.202 175.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.5 mmm -57.13 -39.15 74.59 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 118.438 -0.791 . . . . 0.0 112.927 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -57.62 -53.58 56.61 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.18 0.9 . . . . 0.0 110.505 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtpp -56.95 -46.06 82.36 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.586 0.754 . . . . 0.0 111.692 177.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -68.41 -50.99 48.89 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.516 1.126 . . . . 0.0 110.905 -171.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -28.91 68.24 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.936 0.494 . . . . 0.0 110.275 173.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.09 -89.88 0.02 OUTLIER Glycine 0 CA--C 1.531 1.052 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 168.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -160.63 29.12 0.16 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.739 0.816 . . . . 0.0 112.158 -176.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 22.5 t80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.646 -177.642 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.009 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -146.46 23.72 1.28 Allowed 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.742 1.217 . . . . 0.0 110.92 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -175.06 130.34 0.3 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.201 2.2 . . . . 0.0 106.734 -175.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.7 p -50.66 141.4 12.81 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.802 0.841 . . . . 0.0 110.207 -176.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -55.22 -19.57 8.48 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.054 1.342 . . . . 0.0 113.668 -169.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -81.85 -48.12 11.96 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.124 0.57 . . . . 0.0 111.501 172.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.26 72.01 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.249 1.019 . . . . 0.0 111.457 172.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.51 -58.86 4.79 Favored 'General case' 0 CA--C 1.505 -0.759 0 C-N-CA 127.557 2.343 . . . . 0.0 107.785 173.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 13.5 t -59.24 -32.12 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 118.761 0.71 . . . . 0.0 111.2 -177.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.8 t -66.47 -46.29 76.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.031 0.378 . . . . 0.0 110.558 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.5 t -77.29 -32.44 18.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 125.297 1.439 . . . . 0.0 111.981 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -84.81 -39.39 18.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.929 1.692 . . . . 0.0 108.449 -173.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.22 16.89 70.62 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.2 pt -148.9 142.83 18.58 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.7 158.35 24.87 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -52.77 -41.56 64.18 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 126.226 1.81 . . . . 0.0 110.021 169.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.67 -54.12 30.71 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.13 -36.33 83.93 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 117.451 0.625 . . . . 0.0 110.974 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -61.67 -47.36 85.7 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 123.156 0.583 . . . . 0.0 109.974 177.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.79 -19.12 65.77 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.23 -36.23 22.89 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.731 0.812 . . . . 0.0 111.083 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 mt -61.31 153.1 70.13 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 123.893 0.877 . . . . 0.0 109.797 179.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.19 150.8 87.14 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.616 2.211 . . . . 0.0 111.195 -176.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.42 -34.12 25.96 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.915 1.245 . . . . 0.0 112.808 -179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -68.53 -51.16 45.99 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.712 0.756 . . . . 0.0 110.751 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -62.31 -32.49 73.25 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 -177.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -61.5 -57.22 13.01 Favored 'General case' 0 C--N 1.342 0.248 0 C-N-CA 123.308 0.643 . . . . 0.0 110.664 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.17 -38.56 91.51 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 122.701 0.401 . . . . 0.0 110.663 -176.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -51.86 67.38 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.865 1.266 . . . . 0.0 109.958 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.9 mmm -59.32 -46.81 87.56 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.338 0.655 . . . . 0.0 111.627 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -54.58 -49.62 69.94 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.5 0.591 . . . . 0.0 111.349 177.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.3 mtmt -60.96 -47.37 86.76 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.849 0.295 . . . . 0.0 111.462 176.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -64.24 -54.86 26.77 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.589 0.755 . . . . 0.0 111.473 -172.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -58.1 -29.24 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.472 0.709 . . . . 0.0 110.444 173.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.44 -89.62 0.02 OUTLIER Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.893 1.235 . . . . 0.0 110.201 169.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -158.42 28.1 0.24 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.805 0.842 . . . . 0.0 112.627 -173.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.036 178.912 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.032 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -67.58 110.79 3.83 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.254 0.622 . . . . 0.0 109.601 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 10.9 mp 54.64 82.11 0.1 Allowed 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.545 1.538 . . . . 0.0 112.5 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.6 m -62.22 137.73 58.3 Favored 'General case' 0 C--O 1.225 -0.194 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 168.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.87 -24.89 39.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.623 0.769 . . . . 0.0 112.619 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -81.35 -48.23 12.23 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.816 0.847 . . . . 0.0 111.848 175.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.28 -39.03 74.85 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.87 0.868 . . . . 0.0 111.597 174.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -49.82 -56.02 11.99 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 127.298 2.239 . . . . 0.0 107.75 171.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.07 -30.73 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 119.197 0.908 . . . . 0.0 111.214 -177.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.8 t -66.81 -48.64 68.33 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.429 0.559 . . . . 0.0 110.232 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 77.1 t -73.42 -32.15 35.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 125.302 1.441 . . . . 0.0 112.023 -177.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -86.44 -23.25 26.11 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.169 1.787 . . . . 0.0 109.61 -176.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 51.35 28.18 19.17 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 124.694 1.14 . . . . 0.0 112.82 -172.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 19.9 pt -145.29 143.74 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 172.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.24 158.88 27.76 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.903 0.858 . . . . 0.0 113.274 -176.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -54.67 -40.45 69.09 Favored 'General case' 0 N--CA 1.441 -0.875 0 C-N-CA 125.944 1.697 . . . . 0.0 109.9 170.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.6 -54.39 29.2 Favored Glycine 0 CA--C 1.526 0.742 0 C-N-CA 124.141 0.877 . . . . 0.0 110.92 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -64.35 -38.18 90.13 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 117.353 0.577 . . . . 0.0 110.859 -178.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.11 -49.66 77.02 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.611 0.764 . . . . 0.0 109.941 176.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.2 65.75 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.73 -34.07 21.31 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.93 0.892 . . . . 0.0 111.414 175.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.0 mt -61.63 154.04 67.69 Favored Pre-proline 0 CA--C 1.537 0.455 0 C-N-CA 123.679 0.792 . . . . 0.0 110.452 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -52.09 144.77 36.33 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.312 2.674 . . . . 0.0 112.619 177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.66 -32.78 40.34 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 124.014 0.816 . . . . 0.0 112.595 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.3 p-90 -68.1 -51.47 46.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.718 0.759 . . . . 0.0 110.808 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -61.58 -32.99 73.12 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -61.78 -58.73 6.87 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.127 0.571 . . . . 0.0 110.508 176.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.41 -37.49 86.01 Favored 'General case' 0 C--N 1.339 0.13 0 C-N-CA 122.721 0.408 . . . . 0.0 111.072 -176.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -54.43 47.09 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.957 1.303 . . . . 0.0 109.984 175.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 61.3 mmm -56.78 -43.39 80.82 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 119.159 -0.448 . . . . 0.0 111.559 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -59.7 -48.36 81.98 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 118.929 -0.558 . . . . 0.0 111.865 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.52 70.06 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.844 0.747 . . . . 0.0 111.722 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.94 -63.24 1.17 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.293 0.637 . . . . 0.0 109.682 -177.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -56.39 -30.02 62.22 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.083 0.553 . . . . 0.0 110.463 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -54.04 -87.62 0.01 OUTLIER Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.741 1.638 . . . . 0.0 111.788 169.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -119.86 39.45 3.65 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.656 1.182 . . . . 0.0 113.424 -168.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 47.4 t80 . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.882 -1.056 . . . . 0.0 109.665 173.343 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.94 162.57 21.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.51 0.724 . . . . 0.0 111.532 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.2 mp 54.2 83.8 0.07 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.76 1.224 . . . . 0.0 112.641 174.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.1 m -63.6 133.65 54.1 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 169.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -55.53 -23.67 27.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.77 0.828 . . . . 0.0 113.118 -169.756 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -78.64 -47.45 17.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.76 0.824 . . . . 0.0 111.561 175.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.59 -41.09 89.47 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 122.217 1.008 . . . . 0.0 111.1 174.203 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.9 -52.25 61.13 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 129.328 3.051 . . . . 0.0 108.293 174.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 2.5 t -52.97 -30.99 16.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 119.884 1.22 . . . . 0.0 112.045 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.1 t -68.85 -46.65 67.94 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.825 0.739 . . . . 0.0 110.865 176.668 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 85.8 t -78.08 -28.61 15.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.762 1.625 . . . . 0.0 112.468 -174.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -94.31 -30.03 14.74 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 126.908 2.083 . . . . 0.0 110.146 -173.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 50.52 26.87 10.72 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.98 0.8 . . . . 0.0 112.927 -169.704 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 35.2 pt -136.12 141.31 41.93 Favored 'Isoleucine or valine' 0 C--N 1.344 0.326 0 CA-C-N 117.84 0.82 . . . . 0.0 109.372 169.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -69.39 161.32 29.62 Favored 'General case' 0 CA--C 1.519 -0.238 0 C-N-CA 125.007 1.323 . . . . 0.0 113.408 -176.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ttt180 -54.22 -41.21 68.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.875 1.67 . . . . 0.0 109.762 169.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.75 -54.33 26.02 Favored Glycine 0 C--N 1.339 0.733 0 N-CA-C 110.714 -0.955 . . . . 0.0 110.714 -179.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -63.44 -38.84 92.71 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.833 0.453 . . . . 0.0 111.058 -179.169 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -62.74 -47.73 82.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.29 0.636 . . . . 0.0 109.795 177.815 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.33 -19.54 66.0 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 177.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.74 -35.64 24.25 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.803 0.841 . . . . 0.0 110.977 175.436 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 mt -60.7 152.05 69.37 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 123.597 0.759 . . . . 0.0 109.682 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.78 144.22 44.64 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.977 2.451 . . . . 0.0 112.41 177.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.86 -31.64 47.12 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 123.864 0.745 . . . . 0.0 112.509 177.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.0 p-90 -68.08 -50.98 51.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.668 0.734 . . . . 0.0 110.601 174.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 22.2 tptp -62.49 -31.78 72.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -176.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -62.2 -57.98 9.46 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.324 0.65 . . . . 0.0 110.58 176.155 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.58 84.53 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 122.886 0.475 . . . . 0.0 110.551 -176.216 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -53.08 62.32 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.696 1.198 . . . . 0.0 109.646 175.294 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 58.8 mmm -58.78 -45.34 90.06 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.945 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -53.34 -52.47 59.11 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.456 0.571 . . . . 0.0 111.134 174.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.5 mmtp -60.39 -43.09 96.96 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.584 0.754 . . . . 0.0 111.611 178.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.64 -53.15 16.97 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.053 0.941 . . . . 0.0 110.868 -171.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -59.41 -28.55 67.02 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.552 0.341 . . . . 0.0 110.382 172.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -59.68 -90.37 0.02 OUTLIER Glycine 0 CA--C 1.53 1.021 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 168.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -163.19 24.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.335 0.654 . . . . 0.0 112.645 -176.478 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.8 t80 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 117.547 -1.216 . . . . 0.0 110.016 -176.762 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.032 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -81.53 38.83 0.51 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.969 1.307 . . . . 0.0 111.576 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -173.95 130.87 0.4 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.095 2.158 . . . . 0.0 106.551 -176.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.2 m -43.12 137.04 2.65 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.066 1.346 . . . . 0.0 110.3 -175.811 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -57.51 -20.68 33.07 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -169.279 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -84.83 -46.01 11.76 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.677 0.672 . . . . 0.0 112.532 171.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.85 -37.26 63.46 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.375 1.07 . . . . 0.0 110.712 172.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -52.43 -58.7 5.89 Favored 'General case' 0 C--O 1.216 -0.671 0 C-N-CA 127.216 2.207 . . . . 0.0 107.881 170.299 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 14.9 t -59.16 -31.99 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 118.778 0.717 . . . . 0.0 110.939 -176.81 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -65.28 -49.03 71.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.023 0.374 . . . . 0.0 110.455 177.439 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.3 t -75.16 -33.48 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.449 1.1 . . . . 0.0 111.868 -177.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -80.86 -34.71 33.54 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.054 1.742 . . . . 0.0 108.819 -176.027 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.49 16.0 74.71 Favored Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 177.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.7 pt -151.31 144.9 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.436 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 -175.425 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.28 158.32 29.33 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.0 0.905 . . . . 0.0 113.235 -177.591 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.8 ttt180 -53.83 -39.6 65.7 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.281 1.832 . . . . 0.0 110.086 170.42 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.93 -54.84 27.99 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.07 0.843 . . . . 0.0 111.042 177.176 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -65.01 -36.56 84.77 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 117.437 0.619 . . . . 0.0 110.954 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -59.76 -48.86 79.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.817 0.847 . . . . 0.0 109.994 175.056 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.15 -19.38 65.95 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 178.459 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.64 -34.95 22.97 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 123.836 0.854 . . . . 0.0 111.353 175.193 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.1 mt -60.04 152.89 58.81 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.57 0.748 . . . . 0.0 110.275 179.249 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.13 144.49 37.7 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.24 2.627 . . . . 0.0 112.514 177.552 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.17 -32.13 42.77 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 123.988 0.804 . . . . 0.0 112.496 177.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -68.29 -50.69 51.93 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.685 0.743 . . . . 0.0 110.734 175.157 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -61.94 -32.96 73.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.782 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -61.11 -57.69 11.47 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.883 0.473 . . . . 0.0 110.599 176.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.38 -38.58 91.69 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 122.519 0.328 . . . . 0.0 110.684 -177.149 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -52.33 63.87 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.303 1.441 . . . . 0.0 109.691 175.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.2 mmm -58.7 -49.09 78.86 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 118.511 0.596 . . . . 0.0 111.138 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -57.4 -47.24 82.24 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.569 0.348 . . . . 0.0 111.268 -179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.3 mtmt -62.35 -44.71 95.85 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.852 0.461 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -60.43 -42.7 96.61 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 124.734 1.213 . . . . 0.0 111.588 -172.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -57.26 -30.68 64.87 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.457 0.303 . . . . 0.0 111.023 174.546 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.55 -91.59 0.16 Allowed Glycine 0 CA--C 1.529 0.924 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 169.539 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.52 35.02 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.719 1.208 . . . . 0.0 110.543 -175.199 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.7 t80 . . . . . 0 C--O 1.251 1.161 0 C-N-CA 125.832 1.653 . . . . 0.0 110.013 -169.536 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.023 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -73.54 94.72 2.17 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.438 0.695 . . . . 0.0 109.739 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.61 108.07 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.34 1.856 . . . . 0.0 113.573 169.264 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.0 p -67.28 142.38 56.89 Favored 'General case' 0 C--N 1.342 0.241 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 169.071 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -56.95 -26.47 59.68 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.984 0.914 . . . . 0.0 111.987 -170.207 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -78.73 -48.05 15.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.53 0.732 . . . . 0.0 111.763 177.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.18 -39.39 86.34 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.476 0.58 . . . . 0.0 111.63 174.304 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -51.52 -61.41 2.26 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 127.171 2.188 . . . . 0.0 107.367 170.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.0 t -53.14 -38.86 31.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 119.048 0.84 . . . . 0.0 112.342 178.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.9 t -62.05 -39.78 93.53 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 117.918 0.326 . . . . 0.0 111.463 179.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -89.32 -30.46 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.479 1.512 . . . . 0.0 111.823 -175.132 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.77 -39.37 18.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.095 1.358 . . . . 0.0 108.815 -169.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.13 23.63 56.68 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.072 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -130.39 -165.6 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 172.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.03 159.17 25.28 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 124.939 1.296 . . . . 0.0 112.499 170.755 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -50.46 -41.17 52.53 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 127.162 2.185 . . . . 0.0 110.239 169.877 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.26 -53.83 30.63 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 179.149 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -59.81 -45.46 92.28 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.025 0.53 . . . . 0.0 110.758 178.792 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -61.41 -44.91 96.33 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.326 0.65 . . . . 0.0 110.139 -173.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.58 -18.44 65.33 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 178.638 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -33.83 15.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.059 0.944 . . . . 0.0 111.311 176.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 mt -62.5 152.73 79.67 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 123.691 0.797 . . . . 0.0 110.668 -176.237 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -52.54 144.62 40.84 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.355 2.703 . . . . 0.0 112.544 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.34 -32.94 45.51 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 123.982 0.801 . . . . 0.0 112.638 178.042 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 8.6 p-90 -68.67 -49.18 61.11 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.774 0.787 . . . . 0.0 110.718 175.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -61.92 -32.87 73.31 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -62.52 -58.06 8.92 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.198 0.599 . . . . 0.0 110.344 176.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.85 -35.79 81.79 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.798 0.439 . . . . 0.0 110.978 -177.085 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -56.27 -55.39 33.85 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.875 1.67 . . . . 0.0 110.096 175.336 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 59.6 mmm -56.24 -46.48 79.55 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.777 0.431 . . . . 0.0 110.915 177.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -56.7 -50.03 73.37 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.246 0.461 . . . . 0.0 112.246 178.163 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -71.12 -30.97 67.17 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 118.65 0.659 . . . . 0.0 111.287 -177.108 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -72.96 -57.39 4.08 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.164 0.585 . . . . 0.0 110.898 -177.694 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -59.09 -31.22 68.71 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.02 0.528 . . . . 0.0 110.079 174.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -56.92 -88.54 0.01 OUTLIER Glycine 0 CA--C 1.53 0.981 0 C-N-CA 125.218 1.389 . . . . 0.0 111.073 169.318 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.42 43.1 0.59 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.504 1.122 . . . . 0.0 111.144 -169.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.3 t80 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 127.671 2.389 . . . . 0.0 111.107 -177.916 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.048 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -82.93 35.9 0.49 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.912 1.285 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -176.15 130.71 0.23 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 127.391 2.276 . . . . 0.0 106.661 -177.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.9 p -47.67 149.45 1.23 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 123.883 0.873 . . . . 0.0 111.164 -176.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -57.05 -23.61 47.81 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.874 0.47 . . . . 0.0 112.08 -175.323 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 50.9 mm-40 -84.83 -46.76 11.04 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 173.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -55.09 -37.97 67.51 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.408 0.623 . . . . 0.0 110.085 174.498 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -49.93 -59.65 3.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 127.549 2.34 . . . . 0.0 107.958 169.927 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.2 t -58.76 -32.76 47.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 119.101 0.864 . . . . 0.0 110.881 -177.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.3 t -65.25 -45.43 84.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.016 0.371 . . . . 0.0 110.822 178.628 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.3 t -80.3 -33.37 14.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.376 1.07 . . . . 0.0 111.718 -176.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -79.83 -35.2 38.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.988 1.715 . . . . 0.0 108.634 -175.736 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.33 15.89 75.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 177.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.0 pt -150.28 144.01 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.165 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.95 158.43 30.83 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 122.102 0.953 . . . . 0.0 113.237 -176.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -52.54 -39.86 61.89 Favored 'General case' 0 N--CA 1.442 -0.866 0 C-N-CA 126.456 1.902 . . . . 0.0 110.217 169.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.03 -55.3 25.01 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.139 0.876 . . . . 0.0 111.05 177.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -65.14 -35.68 81.86 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 117.357 0.578 . . . . 0.0 111.042 -178.246 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -60.7 -48.38 82.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.648 0.779 . . . . 0.0 110.005 175.298 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.24 65.84 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 178.224 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.4 -35.13 23.33 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.834 0.854 . . . . 0.0 111.211 175.117 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.25 152.92 60.93 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 123.54 0.736 . . . . 0.0 110.339 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.61 144.51 41.9 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.225 2.617 . . . . 0.0 112.578 177.722 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.86 -32.68 41.6 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.057 0.837 . . . . 0.0 112.591 177.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -68.26 -50.39 54.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.634 0.717 . . . . 0.0 110.779 175.32 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -62.07 -33.0 73.6 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -61.17 -57.44 12.46 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.04 0.536 . . . . 0.0 110.71 176.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 -39.4 94.22 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.545 0.338 . . . . 0.0 110.651 -177.219 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.35 -53.35 55.08 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 125.217 1.407 . . . . 0.0 109.489 175.634 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 45.8 mmm -58.41 -47.48 83.79 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 123.142 0.577 . . . . 0.0 111.58 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -55.61 -49.62 72.33 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.392 0.277 . . . . 0.0 111.404 178.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -64.06 -42.64 96.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 178.15 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -57.29 -42.26 81.35 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.002 1.321 . . . . 0.0 112.271 -173.358 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -59.24 -32.32 69.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.049 0.386 . . . . 0.0 110.775 175.757 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.41 -90.2 0.1 Allowed Glycine 0 CA--C 1.529 0.91 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 169.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -156.53 24.11 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.457 1.103 . . . . 0.0 111.335 -177.223 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.7 t80 . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.673 1.589 . . . . 0.0 110.885 -169.959 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.01 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 37.1 p90 -148.39 23.8 1.02 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.679 1.192 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -170.29 129.66 0.89 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.544 1.538 . . . . 0.0 108.368 -174.312 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 m -39.56 139.69 0.56 Allowed 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 126.604 1.962 . . . . 0.0 111.629 178.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -43.03 -36.04 1.46 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.178 1.391 . . . . 0.0 113.331 -178.454 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -79.46 -44.36 21.47 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 177.176 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -58.84 -34.46 71.58 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.038 0.935 . . . . 0.0 110.464 173.679 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -57.92 -58.93 6.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.637 1.975 . . . . 0.0 107.205 171.53 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.5 t -53.99 -38.13 36.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 119.46 1.027 . . . . 0.0 111.965 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.2 t -61.37 -45.62 93.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.909 0.322 . . . . 0.0 111.197 178.863 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.79 -34.11 12.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 124.934 1.294 . . . . 0.0 111.984 -175.239 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -85.14 -36.25 21.2 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.524 1.53 . . . . 0.0 109.01 -170.622 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.83 7.4 88.04 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 178.494 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.0 pt -139.21 146.99 24.95 Favored 'Isoleucine or valine' 0 C--N 1.341 0.233 0 CA-C-N 117.786 0.793 . . . . 0.0 110.162 -177.725 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -62.54 156.91 21.74 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 122.174 0.988 . . . . 0.0 113.02 -177.286 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.8 ttp180 -57.39 -39.05 75.26 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.22 -1.809 . . . . 0.0 108.805 172.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.44 -53.18 33.8 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.352 0.977 . . . . 0.0 111.105 177.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -64.91 -36.66 85.1 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 117.815 0.807 . . . . 0.0 110.779 -178.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -60.91 -48.33 82.29 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.788 0.435 . . . . 0.0 110.608 176.092 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.85 -19.38 65.85 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 178.026 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.62 -35.79 22.46 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.801 0.84 . . . . 0.0 111.142 175.069 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.0 mt -61.24 150.45 79.48 Favored Pre-proline 0 CA--C 1.536 0.407 0 C-N-CA 123.568 0.747 . . . . 0.0 109.858 179.848 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.14 144.46 37.88 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.164 2.576 . . . . 0.0 112.493 176.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -53.69 -32.0 46.38 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 123.912 0.768 . . . . 0.0 112.608 178.122 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 9.8 p-90 -67.57 -50.61 57.59 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.78 0.79 . . . . 0.0 110.612 174.463 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 tppt? -62.04 -32.25 72.74 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.656 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.75 -57.54 11.51 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 122.83 0.452 . . . . 0.0 110.481 176.487 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -37.18 86.54 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.705 0.402 . . . . 0.0 110.873 -176.524 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -53.53 55.94 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.315 1.446 . . . . 0.0 109.451 173.979 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.9 mmm -57.66 -42.63 83.93 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.525 0.602 . . . . 0.0 111.334 178.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -57.57 -52.03 67.08 Favored 'General case' 0 C--N 1.34 0.155 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.708 177.488 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.36 -35.32 77.56 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.313 0.506 . . . . 0.0 111.514 -176.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -71.5 -59.1 2.94 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -175.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -58.08 -33.26 68.88 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 122.814 0.446 . . . . 0.0 110.625 176.304 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -50.84 -88.12 0.01 OUTLIER Glycine 0 CA--C 1.529 0.923 0 C-N-CA 126.23 1.871 . . . . 0.0 111.3 169.038 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.44 40.64 0.21 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.192 0.597 . . . . 0.0 111.724 -169.774 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.618 -1.182 . . . . 0.0 110.5 -178.799 . . . . . . . . 1 1 . 1 stop_ save_