data_2ami_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 2ami _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' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -45.37 -45.51 12.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.907 0.883 . . . . 0.0 111.863 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -55.95 -47.44 77.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.908 0.483 . . . . 0.0 110.834 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -61.99 -43.97 97.71 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.24 -44.11 92.35 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.233 -0.292 . . . . 0.0 110.849 178.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -57.86 -51.78 68.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.209 0.604 . . . . 0.0 110.006 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -52.96 -50.23 64.51 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.128 0.422 . . . . 0.0 111.058 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.76 -46.09 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 124.023 0.929 . . . . 0.0 110.377 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -61.17 -49.18 78.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.796 -0.565 . . . . 0.0 111.067 177.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -55.83 -52.27 64.58 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.568 -0.708 . . . . 0.0 110.569 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.82 75.25 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.389 0.676 . . . . 0.0 110.554 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.8 -55.52 22.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.553 0.741 . . . . 0.0 110.225 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.64 -50.24 70.73 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.856 0.463 . . . . 0.0 110.24 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 tt -55.8 -53.5 55.89 Favored 'General case' 0 N--CA 1.457 -0.099 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -59.91 -36.86 77.88 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 119.49 -0.29 . . . . 0.0 110.941 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -73.83 60.85 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.458 0.572 . . . . 0.0 109.992 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 p . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.481 1.113 . . . . 0.0 111.175 178.078 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.983 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -138.27 144.99 40.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.952 1.701 . . . . 0.0 107.09 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.5 mt -80.82 116.81 25.73 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.062 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -65.98 147.44 53.35 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.11 0.868 . . . . 0.0 110.3 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.76 -46.76 1.3 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.782 0.833 . . . . 0.0 113.213 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.02 -46.41 89.58 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.806 -0.559 . . . . 0.0 111.233 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.51 -38.81 88.72 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.014 -0.429 . . . . 0.0 109.904 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.8 -43.49 98.66 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.843 -0.536 . . . . 0.0 110.389 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -57.02 -48.75 77.75 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.474 -0.766 . . . . 0.0 110.096 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -55.05 -48.03 76.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.731 -0.605 . . . . 0.0 110.551 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.85 70.48 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.873 0.469 . . . . 0.0 110.633 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.3 mtm -61.6 -38.03 86.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.737 -0.602 . . . . 0.0 111.583 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -60.94 -43.41 98.71 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.464 -0.773 . . . . 0.0 111.355 169.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.45 77.09 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.023 0.829 . . . . 0.0 111.331 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.47 -0.62 13.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.088 0.955 . . . . 0.0 112.501 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.66 24.05 68.46 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.406 1.003 . . . . 0.0 112.709 175.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -80.03 165.95 22.03 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.084 0.942 . . . . 0.0 110.525 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -116.19 92.85 37.24 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.737 1.615 . . . . 0.0 107.835 170.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -53.17 140.08 61.63 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.952 3.101 . . . . 0.0 112.98 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -135.95 119.17 16.63 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -40.31 -58.52 1.5 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.289 1.436 . . . . 0.0 114.633 -169.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -51.41 69.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.774 0.43 . . . . 0.0 111.674 -177.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -57.45 -50.69 72.19 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.921 0.488 . . . . 0.0 110.038 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.76 -54.22 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 123.998 0.919 . . . . 0.0 109.786 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -55.44 -50.95 68.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.444 0.697 . . . . 0.0 110.593 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.7 -51.45 67.15 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -177.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.77 -53.29 56.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.222 0.609 . . . . 0.0 110.071 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -50.67 -49.37 25.7 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.783 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -58.64 -44.73 90.16 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.566 1.075 . . . . 0.0 111.471 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -58.67 -47.78 83.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.432 0.293 . . . . 0.0 110.744 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 34.6 mm -71.6 -34.66 53.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 120.716 0.293 . . . . 0.0 110.772 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -81.08 70.45 7.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 109.442 -174.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 CA--C 1.534 0.335 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.244 173.691 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.878 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -113.54 166.46 11.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.6 mm -118.54 116.88 52.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 125.622 1.569 . . . . 0.0 107.142 176.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.16 160.6 32.17 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.561 1.144 . . . . 0.0 110.651 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -48.68 -48.72 39.83 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.368 0.667 . . . . 0.0 111.781 176.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -63.93 -40.65 96.94 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.787 0.721 . . . . 0.0 111.356 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -62.77 -47.46 83.39 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.68 -0.638 . . . . 0.0 109.654 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -59.31 -46.63 88.06 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.415 0.686 . . . . 0.0 110.715 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.16 -48.17 74.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.693 1.197 . . . . 0.0 109.509 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.3 m -56.75 -51.09 70.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.288 0.494 . . . . 0.0 110.432 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.7 ttp -51.8 -52.08 51.69 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 176.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 C-N-CA 123.092 0.557 . . . . 0.0 111.077 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.7 p . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.984 0.421 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -50.81 -47.14 60.06 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.43 -52.38 46.67 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.352 0.661 . . . . 0.0 110.677 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -57.45 -48.52 78.96 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.147 -0.346 . . . . 0.0 110.62 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -58.52 -40.49 83.07 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.602 0.637 . . . . 0.0 111.707 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -58.33 -52.66 64.68 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.51 0.724 . . . . 0.0 109.838 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.43 -45.97 87.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.202 -0.311 . . . . 0.0 111.352 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.47 -46.45 82.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.729 0.812 . . . . 0.0 109.597 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -61.64 -44.95 96.01 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.383 0.538 . . . . 0.0 111.013 177.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -55.88 -55.25 34.86 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.456 0.571 . . . . 0.0 110.114 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.77 -49.46 70.83 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.871 0.468 . . . . 0.0 110.03 178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -51.82 -52.68 47.46 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.887 0.475 . . . . 0.0 110.733 177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.53 -49.17 75.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.755 0.822 . . . . 0.0 110.606 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 tp -53.37 -54.77 31.83 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -61.58 -43.05 99.58 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.456 -0.152 . . . . 0.0 110.909 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.99 62.69 1.15 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.696 1.198 . . . . 0.0 109.547 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 75.0 p . . . . . 0 CA--C 1.534 0.358 0 C-N-CA 124.131 0.972 . . . . 0.0 111.169 173.83 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.096 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.3 p -148.33 121.71 9.05 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.109 1.764 . . . . 0.0 107.536 -169.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.37 110.38 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 169.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.73 148.68 45.97 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.24 -46.24 1.49 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.551 1.14 . . . . 0.0 113.062 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -59.18 -48.03 83.12 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.061 0.457 . . . . 0.0 110.926 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -61.51 -39.69 91.9 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 122.017 -0.427 . . . . 0.0 109.942 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.2 tp -63.56 -42.56 98.34 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.611 -0.681 . . . . 0.0 110.383 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.74 -48.04 80.75 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.687 -0.633 . . . . 0.0 110.168 175.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -54.23 -49.46 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 122.014 -0.429 . . . . 0.0 110.554 173.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.79 -49.08 69.1 Favored 'General case' 0 C--O 1.225 -0.204 0 O-C-N 121.993 -0.442 . . . . 0.0 110.675 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -61.13 -39.88 91.7 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.084 0.554 . . . . 0.0 111.382 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -60.13 -43.35 95.73 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.245 -0.91 . . . . 0.0 111.437 170.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.85 -37.77 77.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.951 0.796 . . . . 0.0 111.346 173.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -72.82 -0.84 14.52 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.042 0.937 . . . . 0.0 112.647 173.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.43 25.67 69.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.318 0.961 . . . . 0.0 112.616 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -82.55 167.06 18.72 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 117.791 0.796 . . . . 0.0 111.035 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -109.35 107.23 59.5 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 169.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -56.87 77.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.638 3.559 . . . . 0.0 114.459 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -65.84 82.5 0.07 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.364 1.066 . . . . 0.0 109.044 170.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -31.29 -55.4 0.24 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 127.817 2.447 . . . . 0.0 114.288 -169.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 mp0 -59.33 -53.27 60.15 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.33 0.586 . . . . 0.0 110.134 -176.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -62.68 -41.66 99.22 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.764 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.99 -52.83 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.095 0.558 . . . . 0.0 109.89 174.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -51.3 70.15 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -53.34 -56.12 19.31 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.483 0.313 . . . . 0.0 110.577 178.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.0 ttp -50.89 -57.92 7.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.303 0.641 . . . . 0.0 110.103 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -51.47 -44.22 32.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 122.724 0.41 . . . . 0.0 110.022 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.2 m -61.75 -49.44 76.41 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.185 0.448 . . . . 0.0 111.558 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -58.09 -45.22 87.53 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.055 0.389 . . . . 0.0 110.848 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.02 -34.21 49.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.241 -0.287 . . . . 0.0 111.101 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -89.46 88.45 7.46 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.65 0.659 . . . . 0.0 110.35 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 123.72 0.808 . . . . 0.0 112.246 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.1 0 CA-C-O 120.075 -0.292 . . . . 0.0 113.059 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.0 p -137.62 124.62 21.43 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.746 1.219 . . . . 0.0 109.602 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.5 mm -91.59 104.34 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.83 151.3 39.37 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -45.41 -47.98 13.64 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.39 -42.35 86.91 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.499 0.591 . . . . 0.0 111.202 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -66.1 -45.38 81.39 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -55.9 -49.94 72.04 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.697 0.399 . . . . 0.0 110.439 174.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -54.28 -49.75 68.89 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 108.902 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.6 m -55.85 -49.68 72.67 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.932 -0.48 . . . . 0.0 111.087 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.7 ttp -54.0 -51.54 63.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.827 -0.545 . . . . 0.0 110.156 177.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 91.4 mmm . . . . . 0 CA--C 1.535 0.373 0 O-C-N 122.026 -0.422 . . . . 0.0 111.559 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p . . . . . 0 N--CA 1.452 -0.332 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -53.32 -36.07 60.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.166 -0.334 . . . . 0.0 110.112 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.92 -58.12 9.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.948 0.499 . . . . 0.0 110.307 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -52.67 -47.61 67.05 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.86 -0.525 . . . . 0.0 110.685 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -57.61 -44.57 85.56 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.228 -0.295 . . . . 0.0 110.802 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.07 88.11 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.902 -0.499 . . . . 0.0 110.25 177.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -58.13 -48.89 78.83 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 110.225 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -58.58 -41.27 81.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -61.84 -47.7 83.91 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.728 -0.607 . . . . 0.0 111.237 175.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -56.8 -49.31 75.74 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.73 0.695 . . . . 0.0 110.38 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.05 -50.01 67.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.559 0.344 . . . . 0.0 110.736 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -51.77 -57.5 9.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.343 0.657 . . . . 0.0 110.725 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -57.54 -45.71 84.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 110.69 -177.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 tt -56.24 -53.16 60.51 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.0 -37.34 79.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.746 -0.168 . . . . 0.0 110.907 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -73.66 59.82 0.66 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.174 0.443 . . . . 0.0 110.283 170.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 68.2 p . . . . . 0 CA--C 1.533 0.309 0 C-N-CA 124.37 1.068 . . . . 0.0 111.158 176.829 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.979 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p -141.0 145.5 36.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.313 1.845 . . . . 0.0 106.653 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 95.1 mt -82.87 120.08 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.15 146.26 53.59 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.422 1.01 . . . . 0.0 110.426 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.49 -48.33 0.97 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.895 0.878 . . . . 0.0 113.192 173.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.28 -48.27 81.01 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.939 0.496 . . . . 0.0 111.217 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -60.72 -39.51 88.89 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.766 0.426 . . . . 0.0 110.118 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.02 -40.86 99.03 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.869 -0.52 . . . . 0.0 110.549 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -61.07 -47.28 87.09 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.626 -0.671 . . . . 0.0 110.67 174.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -52.86 -50.47 43.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.446 0.566 . . . . 0.0 110.145 173.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.53 -53.65 48.58 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.16 0.584 . . . . 0.0 110.408 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.8 mtm -56.35 -46.1 80.15 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.387 0.675 . . . . 0.0 111.874 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -54.46 -51.02 66.32 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.437 0.562 . . . . 0.0 110.726 172.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.77 73.8 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.966 -0.459 . . . . 0.0 111.763 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.5 mt -74.99 -0.58 19.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.764 1.226 . . . . 0.0 112.258 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.75 25.05 63.41 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 119.189 0.904 . . . . 0.0 112.878 176.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -76.8 166.19 23.68 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.953 0.876 . . . . 0.0 109.259 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -108.77 109.93 61.19 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -58.48 66.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 124.764 3.643 . . . . 0.0 115.94 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.94 90.16 0.43 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 171.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -31.42 -52.28 0.21 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.97 2.108 . . . . 0.0 113.966 -172.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -62.12 -49.11 77.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.341 0.656 . . . . 0.0 110.639 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.68 -47.45 86.2 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.984 0.913 . . . . 0.0 109.307 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.7 mm -54.7 -53.64 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -57.58 -49.39 76.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.615 0.766 . . . . 0.0 110.387 -179.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -54.81 -56.91 14.29 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.453 0.301 . . . . 0.0 110.257 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.3 ttp -51.74 -56.97 10.66 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.793 0.437 . . . . 0.0 110.355 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.51 -50.6 21.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 123.047 0.539 . . . . 0.0 109.631 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.6 m -58.5 -49.07 78.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.312 0.505 . . . . 0.0 111.447 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -56.78 -44.76 82.17 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.85 0.296 . . . . 0.0 111.079 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.3 mm -71.51 -35.09 55.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 121.997 -0.44 . . . . 0.0 111.118 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -80.12 73.92 6.93 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.563 0.745 . . . . 0.0 110.744 -170.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm . . . . . 0 CA--C 1.537 0.449 0 C-N-CA 123.232 0.613 . . . . 0.0 111.727 173.49 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.845 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.6 p -105.95 170.24 8.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -121.46 119.21 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.671 1.588 . . . . 0.0 107.153 177.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.2 157.51 37.6 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.751 0.82 . . . . 0.0 110.479 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -47.14 -50.15 20.91 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 123.515 0.726 . . . . 0.0 112.081 177.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -61.11 -39.81 91.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.41 0.55 . . . . 0.0 111.203 -178.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -66.38 -46.64 75.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.671 0.789 . . . . 0.0 109.75 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -56.4 -46.97 79.91 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.17 0.588 . . . . 0.0 110.331 174.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.68 -45.73 81.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.643 0.777 . . . . 0.0 109.213 176.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.9 m -53.43 -54.24 39.74 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.797 -0.564 . . . . 0.0 110.879 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -53.62 -51.85 61.73 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.081 0.552 . . . . 0.0 110.15 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.452 -0.363 0 C-N-CA 123.279 0.632 . . . . 0.0 110.06 -179.672 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 59.9 p . . . . . 0 N--CA 1.453 -0.314 0 CA-C-O 121.364 0.602 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -55.16 -42.63 73.35 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 169.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.61 -57.45 8.19 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.834 0.854 . . . . 0.0 110.485 173.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -56.0 -49.12 74.51 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.155 -0.34 . . . . 0.0 111.29 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -60.37 -40.88 92.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.173 -179.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -58.37 -52.02 67.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.1 0.409 . . . . 0.0 110.748 172.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -50.78 -49.47 58.2 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.564 0.62 . . . . 0.0 110.595 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.25 -45.08 93.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 122.976 0.51 . . . . 0.0 110.395 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.04 95.8 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 111.885 178.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -44.38 70.82 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 109.951 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.16 -49.38 71.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.898 -0.501 . . . . 0.0 109.854 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -52.42 -51.44 59.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.274 0.63 . . . . 0.0 110.357 175.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -52.87 -53.17 52.89 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.839 0.455 . . . . 0.0 111.211 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -53.88 -53.82 47.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.947 0.499 . . . . 0.0 109.848 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -59.62 -39.19 83.48 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.812 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -73.57 60.61 0.67 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.37 0.532 . . . . 0.0 109.97 171.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.8 p . . . . . 0 CA--C 1.531 0.218 0 C-N-CA 124.945 1.298 . . . . 0.0 111.58 -179.266 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.836 0 N-CA-C 109.851 -1.3 . . . . 0.0 109.851 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.0 p -116.19 142.25 47.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.395 1.478 . . . . 0.0 109.06 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.0 mt -74.36 124.19 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.078 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -71.53 147.07 48.07 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.009 0.822 . . . . 0.0 110.193 172.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.0 -49.4 0.82 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.158 0.983 . . . . 0.0 113.317 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.46 -46.18 87.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.845 -0.534 . . . . 0.0 111.163 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.54 -39.36 93.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.67 0.388 . . . . 0.0 110.192 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.05 -44.3 96.98 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.757 -0.59 . . . . 0.0 110.016 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.54 -46.84 85.99 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.44 -0.787 . . . . 0.0 110.918 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -52.7 -51.9 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 118.3 0.5 . . . . 0.0 110.113 171.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.03 -53.86 43.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.837 0.455 . . . . 0.0 110.594 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.8 mtm -60.47 -41.45 94.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.153 0.581 . . . . 0.0 111.666 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.65 -48.36 79.67 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.22 -37.95 81.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.16 0.584 . . . . 0.0 111.626 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.0 mt -69.5 -1.31 8.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.202 1.001 . . . . 0.0 111.936 173.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.33 8.26 74.95 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.49 1.043 . . . . 0.0 112.504 174.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -73.79 162.63 28.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.557 1.178 . . . . 0.0 109.1 -177.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -104.73 91.76 4.49 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.35 75.48 2.41 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.14 1.893 . . . . 0.0 112.794 -173.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -64.85 123.08 18.45 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.716 0.806 . . . . 0.0 109.736 171.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -42.16 -59.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.83 1.652 . . . . 0.0 113.298 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mp0 -61.26 -49.87 75.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.365 0.602 . . . . 0.0 109.999 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -57.83 -47.27 83.14 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.159 0.984 . . . . 0.0 109.452 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.6 mm -61.97 -46.67 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 122.804 0.441 . . . . 0.0 110.897 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -56.53 -48.73 76.65 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.561 0.618 . . . . 0.0 110.141 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -57.07 -56.31 23.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.41 0.284 . . . . 0.0 110.421 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -49.67 -57.66 6.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.395 1.478 . . . . 0.0 110.995 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.1 mt -51.67 -50.94 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 123.233 0.613 . . . . 0.0 109.66 177.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.7 m -57.87 -46.19 85.24 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.551 0.614 . . . . 0.0 111.825 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -57.23 -46.25 83.14 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 117.841 0.292 . . . . 0.0 110.931 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.72 -34.66 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 122.336 -0.228 . . . . 0.0 111.285 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -77.01 75.91 3.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.331 0.652 . . . . 0.0 111.014 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 123.162 0.585 . . . . 0.0 110.822 173.46 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.884 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 p -102.85 175.67 5.41 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.4 mm -125.52 118.59 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.938 1.695 . . . . 0.0 106.945 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.5 158.88 34.07 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.963 0.905 . . . . 0.0 110.679 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -48.8 -48.18 41.55 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 123.246 0.618 . . . . 0.0 111.551 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -59.85 -48.32 82.15 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.393 0.542 . . . . 0.0 110.877 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.01 -47.25 83.62 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.923 0.489 . . . . 0.0 109.848 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -58.06 -49.38 77.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.324 0.65 . . . . 0.0 111.223 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.39 -47.33 79.17 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.605 0.762 . . . . 0.0 109.041 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.1 m -57.17 -52.16 66.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.897 0.479 . . . . 0.0 110.397 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -52.64 -53.99 39.43 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.979 0.911 . . . . 0.0 110.222 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.451 -0.42 0 C-N-CA 123.829 0.852 . . . . 0.0 109.681 -179.469 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.0 p . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 121.304 0.574 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -52.9 -45.65 67.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 121.768 -0.583 . . . . 0.0 109.947 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.09 -56.84 10.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.681 0.792 . . . . 0.0 110.214 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.55 -44.35 72.8 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 119.563 -0.256 . . . . 0.0 111.056 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -60.79 -39.56 89.35 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.73 0.695 . . . . 0.0 111.834 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -61.81 -49.61 75.64 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.657 0.662 . . . . 0.0 109.42 175.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -53.44 -48.89 68.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.622 0.369 . . . . 0.0 110.459 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -57.49 -44.91 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.937 0.895 . . . . 0.0 110.365 176.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -59.3 -51.65 69.02 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.438 0.563 . . . . 0.0 110.944 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -57.59 -47.38 82.29 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.055 -0.403 . . . . 0.0 110.596 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.94 -52.81 59.44 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.777 0.431 . . . . 0.0 110.306 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.12 -54.84 21.41 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 121.302 0.573 . . . . 0.0 110.469 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.16 -49.77 71.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.984 0.914 . . . . 0.0 110.424 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.03 -53.25 60.23 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.066 0.547 . . . . 0.0 110.502 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -59.5 -34.37 72.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.265 -176.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.04 58.48 0.49 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.516 0.598 . . . . 0.0 110.536 170.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 69.3 p . . . . . 0 CA--C 1.532 0.269 0 C-N-CA 124.58 1.152 . . . . 0.0 110.998 178.123 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.763 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -106.18 145.06 32.0 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.284 1.433 . . . . 0.0 108.561 171.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.3 mt -78.0 121.0 29.84 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.67 146.57 54.64 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.971 0.805 . . . . 0.0 110.427 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.94 -48.93 1.64 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.784 0.834 . . . . 0.0 113.023 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -60.64 -45.14 95.2 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.994 0.518 . . . . 0.0 111.23 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -60.28 -42.45 95.46 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.64 -43.15 99.4 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.566 0.621 . . . . 0.0 110.487 176.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.03 -47.64 84.5 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.553 -0.717 . . . . 0.0 110.864 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.33 -42.42 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 122.895 0.478 . . . . 0.0 110.595 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.84 -54.98 40.77 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.575 -0.703 . . . . 0.0 110.252 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 63.3 mtm -56.46 -47.29 79.5 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.359 0.664 . . . . 0.0 110.736 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -49.81 -55.05 15.63 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.388 0.275 . . . . 0.0 110.591 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.35 81.65 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.615 0.766 . . . . 0.0 111.624 179.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.0 mt -66.66 -6.32 15.07 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 112.053 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.28 15.92 45.74 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 118.983 0.811 . . . . 0.0 112.449 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -76.45 165.94 24.11 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.126 0.963 . . . . 0.0 109.437 172.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -113.57 97.9 45.25 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 105.445 -2.057 . . . . 0.0 105.445 169.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -54.47 88.28 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.837 3.025 . . . . 0.0 115.208 -173.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -66.52 82.38 0.1 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.069 0.948 . . . . 0.0 109.828 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -30.96 -58.49 0.22 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.605 2.362 . . . . 0.0 114.44 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -62.29 -51.33 68.1 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.856 -0.528 . . . . 0.0 110.568 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -59.84 -44.73 93.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.521 0.728 . . . . 0.0 110.145 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -53.2 -54.57 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.911 0.884 . . . . 0.0 109.924 175.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -57.61 -48.37 79.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.825 0.45 . . . . 0.0 110.898 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -55.84 -55.18 35.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.696 0.226 . . . . 0.0 110.499 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 48.7 ttp -53.35 -55.26 26.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.29 0.636 . . . . 0.0 110.238 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.3 mt -49.02 -50.54 14.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 123.219 0.608 . . . . 0.0 109.598 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -58.51 -48.31 81.26 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.47 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.88 -42.35 84.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.767 0.427 . . . . 0.0 111.362 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 51.6 mm -74.07 -34.46 38.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 117.966 0.348 . . . . 0.0 111.031 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -76.5 75.45 3.23 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.472 1.109 . . . . 0.0 110.029 -177.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -172.665 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.259 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.7 p -138.74 159.23 42.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.66 0.784 . . . . 0.0 110.396 -173.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.9 mm -111.49 120.38 61.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.358 1.463 . . . . 0.0 108.299 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.37 153.94 35.34 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.31 0.644 . . . . 0.0 110.397 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -50.66 -43.37 57.28 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.346 0.658 . . . . 0.0 112.34 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.9 -45.61 93.93 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.472 0.578 . . . . 0.0 110.759 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -62.14 -46.85 87.15 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -56.41 -50.42 71.67 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.774 0.83 . . . . 0.0 110.877 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.3 tp -57.62 -44.64 85.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.44 0.696 . . . . 0.0 109.995 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.4 m -58.54 -50.07 75.11 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.951 -0.468 . . . . 0.0 110.378 176.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -54.98 -47.0 75.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.838 0.855 . . . . 0.0 110.521 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt . . . . . 0 N--CA 1.454 -0.265 0 O-C-N 122.135 -0.353 . . . . 0.0 110.521 173.23 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.2 p . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -52.18 -45.76 65.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.884 -0.51 . . . . 0.0 110.58 172.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -53.29 -55.69 22.58 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.711 0.805 . . . . 0.0 110.389 176.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -55.05 -44.31 74.59 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.488 -0.292 . . . . 0.0 110.563 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -60.0 -39.25 85.12 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.818 0.735 . . . . 0.0 111.659 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -62.16 -50.27 72.51 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.188 0.903 . . . . 0.0 109.721 176.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -53.48 -49.61 67.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.033 0.445 . . . . 0.0 110.172 177.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.3 mt -60.89 -41.34 88.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.49 1.116 . . . . 0.0 110.435 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.11 -47.14 85.91 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.878 0.763 . . . . 0.0 110.683 175.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -55.95 -54.68 41.82 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.73 -49.23 68.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.165 0.586 . . . . 0.0 110.446 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -52.22 -56.08 17.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.894 0.878 . . . . 0.0 110.702 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -54.5 -49.97 68.92 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 110.583 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -56.39 -53.85 52.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.198 0.199 . . . . 0.0 110.607 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -60.19 -35.17 74.77 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.454 0.302 . . . . 0.0 111.065 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -72.35 58.47 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.218 0.607 . . . . 0.0 110.421 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.2 p . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 110.967 177.015 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 42.5 p -156.63 135.32 11.64 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 104.751 -2.315 . . . . 0.0 104.751 -169.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.1 mt -85.07 116.25 28.23 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -63.88 144.24 57.22 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.82 0.737 . . . . 0.0 109.767 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.21 -46.31 1.48 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 174.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -54.99 -52.65 62.43 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.385 0.674 . . . . 0.0 111.019 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -58.19 -38.92 77.66 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.026 0.531 . . . . 0.0 109.912 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.2 tp -65.37 -45.69 83.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.512 0.596 . . . . 0.0 111.551 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.282 20.3 pttp -62.28 -39.4 92.81 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.88 -1.137 . . . . 0.0 111.673 175.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.8 -50.35 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.346 0.521 . . . . 0.0 110.151 171.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -53.03 57.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.875 0.87 . . . . 0.0 110.309 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtm -57.28 -42.21 81.21 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.736 0.414 . . . . 0.0 111.421 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -56.15 18.01 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 172.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.79 -39.12 73.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.197 0.599 . . . . 0.0 112.003 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.1 mt -70.64 -6.79 39.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.53 1.132 . . . . 0.0 112.539 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.4 22.61 36.81 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.456 1.025 . . . . 0.0 112.774 175.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -76.19 -179.2 4.88 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.211 1.005 . . . . 0.0 109.916 174.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.36 102.87 36.04 Favored Pre-proline 0 N--CA 1.452 -0.359 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 169.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -59.96 69.8 0.07 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.021 3.147 . . . . 0.0 115.699 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.49 88.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -32.15 -49.33 0.19 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.0 2.12 . . . . 0.0 115.074 -173.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -60.98 -48.27 82.6 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.571 0.623 . . . . 0.0 111.144 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -68.53 -42.43 78.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.457 0.703 . . . . 0.0 109.577 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mm -52.72 -57.69 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.329 0.651 . . . . 0.0 109.336 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -54.68 -51.05 66.74 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.805 0.842 . . . . 0.0 110.475 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -54.16 -57.92 9.33 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.197 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.3 ttp -56.92 -53.04 62.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.494 0.317 . . . . 0.0 110.254 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.4 mt -50.19 -49.79 21.84 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.299 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.2 m -58.3 -48.39 80.64 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.372 0.533 . . . . 0.0 111.482 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -57.72 -45.07 86.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.424 0.29 . . . . 0.0 111.401 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.4 mm -71.69 -33.62 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 122.206 -0.308 . . . . 0.0 110.832 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -75.81 69.84 2.51 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.03 0.932 . . . . 0.0 110.163 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? . . . . . 0 N--CA 1.445 -0.704 0 C-N-CA 124.586 1.154 . . . . 0.0 110.875 173.712 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.846 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.5 p -106.63 167.71 9.67 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.9 mm -121.04 113.7 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.775 1.63 . . . . 0.0 106.804 173.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -71.56 159.32 34.66 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.402 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -50.94 -43.86 60.25 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.259 0.624 . . . . 0.0 112.03 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.91 -48.52 81.35 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.387 0.54 . . . . 0.0 110.722 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -60.11 -47.44 85.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.852 0.461 . . . . 0.0 109.931 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -56.88 -50.37 72.69 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.755 0.822 . . . . 0.0 110.456 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.64 -44.17 89.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.389 0.676 . . . . 0.0 109.88 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.0 m -56.97 -49.61 75.19 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.907 -0.496 . . . . 0.0 110.221 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 61.2 ttp -52.67 -50.94 62.25 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 C--O 1.224 -0.257 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -178.361 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.9 p . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -55.77 -36.75 67.69 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.745 -0.597 . . . . 0.0 110.519 169.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -68.95 -46.36 68.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.668 -0.645 . . . . 0.0 109.562 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.39 -43.06 88.37 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.457 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.37 -45.78 92.29 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.921 0.782 . . . . 0.0 111.166 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -54.36 -54.3 42.35 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.15 0.432 . . . . 0.0 110.232 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -54.25 -46.78 72.69 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.257 0.623 . . . . 0.0 111.054 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.0 mt -59.59 -45.97 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.307 0.643 . . . . 0.0 110.3 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -60.15 -45.94 91.37 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.653 -0.655 . . . . 0.0 110.879 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -57.19 -51.72 68.2 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.072 0.549 . . . . 0.0 110.323 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -49.39 72.03 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.84 0.456 . . . . 0.0 110.691 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -52.79 -57.17 11.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.48 0.712 . . . . 0.0 110.263 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -52.46 -50.56 62.41 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.241 1.016 . . . . 0.0 110.836 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.23 -54.71 43.73 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -59.86 -33.58 71.99 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.424 -0.172 . . . . 0.0 111.044 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -72.51 51.55 0.26 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.449 1.099 . . . . 0.0 110.796 172.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 CA--C 1.531 0.228 0 C-N-CA 124.934 1.294 . . . . 0.0 111.618 -176.964 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.12 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.7 p -155.48 120.55 4.84 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -173.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -78.95 122.19 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.67 145.32 48.97 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 174.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.99 -48.24 0.76 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.615 1.166 . . . . 0.0 113.052 172.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.75 -48.62 80.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.021 0.528 . . . . 0.0 111.111 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -59.99 -42.47 94.29 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.027 -0.421 . . . . 0.0 109.888 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -62.64 -40.86 98.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.947 -0.471 . . . . 0.0 110.534 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -60.23 -47.76 84.59 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.6 t -54.55 -48.97 69.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 CA-C-N 118.216 0.462 . . . . 0.0 110.2 173.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.75 -51.17 64.23 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.163 -0.336 . . . . 0.0 110.592 176.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.9 mtm -59.21 -42.09 90.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.377 0.671 . . . . 0.0 111.948 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -57.69 -49.41 76.6 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.516 0.598 . . . . 0.0 110.018 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.95 -39.15 77.39 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.947 -0.471 . . . . 0.0 111.63 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -72.37 -1.88 17.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.528 1.131 . . . . 0.0 112.337 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 27.12 72.11 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-N 119.054 0.843 . . . . 0.0 112.373 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -80.78 164.07 23.01 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -106.05 92.51 6.62 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 107.634 -1.246 . . . . 0.0 107.634 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -75.8 75.84 3.91 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.115 1.876 . . . . 0.0 112.227 -169.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.14 98.68 0.11 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.692 1.197 . . . . 0.0 110.128 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -31.71 -57.09 0.28 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.314 2.245 . . . . 0.0 113.867 -174.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -51.71 -49.88 61.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.234 0.614 . . . . 0.0 111.176 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -70.5 -41.75 72.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 mm -57.0 -46.77 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.141 0.576 . . . . 0.0 110.995 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -55.52 -51.54 66.66 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.297 0.499 . . . . 0.0 110.421 177.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -59.37 -51.42 69.98 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.291 -0.255 . . . . 0.0 110.695 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.8 ttp -50.0 -56.79 9.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.535 0.734 . . . . 0.0 109.974 177.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -50.65 -49.72 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 C-N-CA 123.526 0.73 . . . . 0.0 109.563 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 p -58.56 -47.02 85.63 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.479 0.581 . . . . 0.0 111.219 -178.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -60.56 -43.42 97.28 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.642 0.777 . . . . 0.0 110.903 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.5 mm -71.53 -34.15 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 O-C-N 122.218 -0.301 . . . . 0.0 110.766 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -78.47 67.31 4.22 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.586 -0.696 . . . . 0.0 110.559 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 125.921 1.688 . . . . 0.0 113.028 176.474 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.045 0 CA-C-O 120.046 -0.308 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.4 p -161.32 161.56 30.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -170.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.8 mm -99.88 110.09 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.18 158.07 36.47 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.578 0.751 . . . . 0.0 110.299 170.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.46 -47.74 38.1 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.707 0.803 . . . . 0.0 112.24 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.51 -40.73 95.65 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.356 0.525 . . . . 0.0 110.733 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -65.6 -45.93 81.29 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.32 -47.31 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.65 0.78 . . . . 0.0 111.1 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.1 tp -57.15 -49.02 77.26 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.527 0.731 . . . . 0.0 109.699 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 m -55.67 -48.76 74.5 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.573 0.349 . . . . 0.0 110.257 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 28.0 ttt -52.95 -54.1 39.95 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.868 0.867 . . . . 0.0 110.23 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 CA--C 1.533 0.324 0 O-C-N 122.056 -0.403 . . . . 0.0 111.087 176.679 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.0 p . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -59.46 -39.64 84.29 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 173.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -52.99 -55.22 25.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.765 1.226 . . . . 0.0 110.69 169.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -56.53 -49.13 75.68 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.447 -0.783 . . . . 0.0 110.702 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -59.11 -40.08 84.24 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.263 0.483 . . . . 0.0 111.616 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.78 -55.83 27.72 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.561 0.619 . . . . 0.0 110.6 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -53.76 -48.58 69.59 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.735 0.302 . . . . 0.0 110.847 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 86.1 mt -58.96 -47.54 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 123.915 0.886 . . . . 0.0 110.334 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -58.88 -51.78 68.55 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.145 0.578 . . . . 0.0 110.59 177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -56.19 -51.54 67.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.054 0.542 . . . . 0.0 110.304 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.33 -51.03 69.75 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 110.814 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -50.18 -58.65 5.13 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.987 0.915 . . . . 0.0 109.706 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -52.81 -51.35 61.17 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.812 0.845 . . . . 0.0 110.252 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tt -56.18 -52.81 63.04 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.114 0.166 . . . . 0.0 111.055 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -60.17 -40.65 90.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.814 0.34 . . . . 0.0 110.706 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -77.28 40.21 0.27 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.651 1.18 . . . . 0.0 112.552 -171.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 125.761 1.624 . . . . 0.0 111.653 -174.913 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.59 0 N-CA-C 108.71 -1.756 . . . . 0.0 108.71 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.1 p -137.74 130.89 30.48 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.319 0.648 . . . . 0.0 109.684 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.9 mt -73.76 112.2 10.04 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.42 146.83 50.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.057 0.39 . . . . 0.0 110.037 172.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.91 -48.0 0.73 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.043 0.937 . . . . 0.0 113.067 172.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -58.78 -46.75 86.82 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.176 0.59 . . . . 0.0 111.441 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.94 -39.76 93.21 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.862 -0.523 . . . . 0.0 109.644 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.51 -43.21 99.37 Favored 'General case' 0 CA--C 1.532 0.262 0 O-C-N 121.82 -0.55 . . . . 0.0 110.518 174.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -58.2 -48.19 81.11 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.459 -0.775 . . . . 0.0 110.478 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.35 -48.47 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 122.183 -0.323 . . . . 0.0 110.294 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -50.39 66.62 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.678 0.391 . . . . 0.0 110.635 177.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.4 mtm -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.437 0.695 . . . . 0.0 111.359 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -57.37 -46.74 83.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.893 0.77 . . . . 0.0 111.087 171.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.41 -38.23 76.98 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.754 -0.591 . . . . 0.0 111.479 175.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.2 mt -73.16 0.01 12.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.471 1.108 . . . . 0.0 112.456 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.3 71.95 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.184 0.897 . . . . 0.0 113.021 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -76.78 160.37 29.35 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.042 0.921 . . . . 0.0 109.755 177.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -107.18 108.31 61.71 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 169.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -56.3 76.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.445 3.43 . . . . 0.0 115.201 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.7 mmmm -65.7 80.38 0.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.958 1.303 . . . . 0.0 108.855 169.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -31.86 -52.51 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.208 2.203 . . . . 0.0 115.07 -170.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -63.33 -45.37 91.59 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.519 -0.738 . . . . 0.0 111.379 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.76 -43.57 88.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.7 mm -55.76 -48.29 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.055 0.542 . . . . 0.0 109.897 174.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -49.79 76.46 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.799 -0.563 . . . . 0.0 110.87 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -54.91 -56.04 23.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.802 0.273 . . . . 0.0 110.532 177.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.6 ttt -47.7 -62.46 1.44 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.183 1.393 . . . . 0.0 110.187 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.72 -49.05 26.95 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 123.088 0.555 . . . . 0.0 109.62 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -58.61 -49.85 75.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.552 0.615 . . . . 0.0 111.601 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -56.81 -44.65 82.2 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.864 0.466 . . . . 0.0 111.042 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 mm -71.85 -34.58 51.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 O-C-N 122.325 -0.234 . . . . 0.0 111.011 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -76.86 73.24 3.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.776 0.83 . . . . 0.0 110.263 -175.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 123.522 0.729 . . . . 0.0 111.136 174.676 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -108.66 159.98 16.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.0 mm -116.99 108.79 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 126.193 1.797 . . . . 0.0 106.742 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -69.09 155.99 39.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.778 0.831 . . . . 0.0 110.139 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -46.33 -47.01 18.55 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.184 0.594 . . . . 0.0 112.155 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -58.48 -43.84 89.14 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.674 0.67 . . . . 0.0 110.779 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.12 -43.14 92.95 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -58.41 -49.0 78.83 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.406 0.622 . . . . 0.0 110.495 176.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.17 -42.47 86.08 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.305 0.642 . . . . 0.0 110.027 175.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 m -56.89 -47.5 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.525 0.602 . . . . 0.0 110.288 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.1 tmm? -55.38 -48.21 74.65 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.101 -0.374 . . . . 0.0 110.664 175.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.3 mmt . . . . . 0 CA--C 1.53 0.181 0 O-C-N 122.119 -0.363 . . . . 0.0 110.322 177.892 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 51.7 p . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 121.184 0.516 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -48.59 -41.2 30.03 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.351 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -53.01 -53.6 47.67 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.939 0.896 . . . . 0.0 110.14 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.55 -40.23 93.94 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.52 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -55.41 -46.24 76.63 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.522 0.601 . . . . 0.0 110.561 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -58.63 -50.79 72.55 Favored 'General case' 0 C--O 1.225 -0.19 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -53.76 -48.31 69.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.524 0.33 . . . . 0.0 111.243 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.13 -46.54 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.171 0.588 . . . . 0.0 109.676 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -61.34 -44.59 96.93 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.895 -0.503 . . . . 0.0 111.417 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -56.78 -50.46 72.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.706 -0.621 . . . . 0.0 110.006 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.31 69.16 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.466 0.306 . . . . 0.0 110.575 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -51.28 -57.66 8.26 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.453 0.701 . . . . 0.0 111.078 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -56.74 -46.95 81.05 Favored 'General case' 0 C--O 1.227 -0.095 0 C-N-CA 123.142 0.577 . . . . 0.0 110.674 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.1 tt -56.1 -52.81 62.98 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.497 0.319 . . . . 0.0 110.248 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -60.06 -40.43 89.46 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -72.56 59.97 0.46 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.709 0.404 . . . . 0.0 110.808 170.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.8 p . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 124.774 1.23 . . . . 0.0 111.275 176.103 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.225 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 79.0 p -151.77 149.52 29.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.366 2.266 . . . . 0.0 106.498 -171.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.7 mt -86.71 115.76 28.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.95 145.9 55.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.269 0.94 . . . . 0.0 110.651 174.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.6 -50.04 1.13 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.927 0.891 . . . . 0.0 113.069 173.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -54.36 -53.68 50.64 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.693 0.797 . . . . 0.0 110.655 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -58.71 -37.56 76.41 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.628 0.771 . . . . 0.0 110.412 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.1 tp -67.07 -46.61 73.78 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.885 -0.509 . . . . 0.0 110.876 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.283 21.1 pttp -63.65 -36.03 82.5 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.487 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.4 t -57.38 -48.57 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 118.286 0.494 . . . . 0.0 110.502 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.85 -50.66 65.74 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.834 -0.541 . . . . 0.0 110.003 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 19.0 mtm -57.12 -45.77 83.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.68 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -54.19 -50.56 66.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.863 0.756 . . . . 0.0 110.48 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.92 -40.25 75.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.123 -0.361 . . . . 0.0 111.219 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.5 mt -74.25 1.76 10.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.264 1.026 . . . . 0.0 112.798 175.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.95 20.17 65.9 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.181 0.901 . . . . 0.0 113.292 174.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -77.77 163.1 26.43 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.149 0.974 . . . . 0.0 109.506 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -109.02 108.18 60.44 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.79 76.11 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.597 3.531 . . . . 0.0 115.669 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.41 84.01 0.16 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -31.48 -57.87 0.26 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 127.426 2.291 . . . . 0.0 114.067 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.71 -44.74 81.87 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.675 -0.641 . . . . 0.0 111.634 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -71.0 -39.02 72.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.8 mm -54.02 -49.15 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 171.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -58.81 -49.75 76.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.963 -0.541 . . . . 0.0 111.386 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -52.32 -58.16 7.52 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.529 0.604 . . . . 0.0 110.103 177.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.7 ttt -49.03 -60.93 2.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.921 1.288 . . . . 0.0 110.16 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.7 mt -50.48 -49.05 25.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 122.967 0.507 . . . . 0.0 109.71 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.5 m -58.83 -49.27 78.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.333 0.515 . . . . 0.0 111.581 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.04 -45.04 83.48 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.715 0.234 . . . . 0.0 111.203 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.1 mm -72.0 -34.33 50.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 O-C-N 122.034 -0.416 . . . . 0.0 111.02 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -78.42 74.01 4.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.886 0.874 . . . . 0.0 110.404 -174.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 123.061 0.545 . . . . 0.0 111.133 173.589 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.837 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -112.04 161.42 16.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.8 mm -104.82 123.13 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 124.914 1.285 . . . . 0.0 107.65 173.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -74.79 161.15 29.86 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.756 0.823 . . . . 0.0 110.105 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.08 -46.81 84.83 Favored 'General case' 0 C--O 1.226 -0.155 0 O-C-N 121.955 -0.466 . . . . 0.0 111.573 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -57.91 -46.62 84.69 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.946 0.339 . . . . 0.0 110.951 178.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -58.73 -51.4 70.1 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.073 0.549 . . . . 0.0 109.985 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -54.74 -51.95 64.05 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.51 0.724 . . . . 0.0 110.822 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.58 -48.71 71.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.241 0.617 . . . . 0.0 109.908 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.3 m -56.61 -49.55 74.62 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.403 0.281 . . . . 0.0 110.532 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.6 ttp -54.82 -53.25 57.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.771 0.829 . . . . 0.0 110.62 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 92.5 mmm . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.137 0.575 . . . . 0.0 110.441 179.633 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 64.7 p . . . . . 0 CA--C 1.532 0.282 0 CA-C-O 121.034 0.445 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -54.1 -36.84 63.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.106 0.479 . . . . 0.0 110.286 171.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -61.94 -51.45 68.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.528 -0.732 . . . . 0.0 109.682 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -53.47 -47.3 69.91 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.143 0.428 . . . . 0.0 110.712 174.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -55.79 -48.06 76.02 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.554 0.616 . . . . 0.0 111.243 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -56.15 -51.25 68.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.778 0.431 . . . . 0.0 110.883 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -55.13 -51.14 67.38 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.261 0.624 . . . . 0.0 110.8 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.5 mt -58.76 -46.58 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.16 0.584 . . . . 0.0 109.725 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -59.39 -47.39 85.65 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.895 -0.503 . . . . 0.0 110.852 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.33 -53.17 60.52 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.086 0.554 . . . . 0.0 110.271 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.68 -48.94 71.79 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.646 0.378 . . . . 0.0 110.587 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -52.7 -57.62 9.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.936 0.895 . . . . 0.0 110.787 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -56.56 -47.88 78.53 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.413 0.685 . . . . 0.0 110.449 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.35 -53.21 59.05 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.76 0.254 . . . . 0.0 110.365 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -60.82 -38.47 85.52 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.987 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.75 61.9 0.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.62 0.645 . . . . 0.0 109.684 170.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.7 p . . . . . 0 CA--C 1.532 0.26 0 C-N-CA 124.768 1.227 . . . . 0.0 111.369 179.514 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.056 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.6 p -137.78 147.98 45.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.591 1.956 . . . . 0.0 107.562 -177.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -80.33 122.89 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.81 145.53 52.06 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.061 0.846 . . . . 0.0 110.086 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.18 -46.4 2.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.924 0.89 . . . . 0.0 113.146 175.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -60.72 -46.27 91.07 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.927 -0.483 . . . . 0.0 111.047 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -60.31 -38.9 85.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.8 tp -62.75 -43.4 98.91 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.814 -0.554 . . . . 0.0 110.257 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.2 -47.84 82.19 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.563 -0.711 . . . . 0.0 110.34 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.1 t -55.23 -49.23 74.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 122.246 -0.284 . . . . 0.0 110.325 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.59 -48.9 68.8 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.974 0.509 . . . . 0.0 110.695 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mtm -62.26 -41.4 98.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.295 0.638 . . . . 0.0 111.426 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -57.44 -46.08 83.98 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.807 0.731 . . . . 0.0 110.802 170.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.95 -38.44 79.06 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.597 0.635 . . . . 0.0 111.531 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.0 mt -71.6 -0.44 10.71 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.198 0.999 . . . . 0.0 112.378 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.8 18.87 74.36 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.231 0.92 . . . . 0.0 112.66 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -78.38 160.21 27.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.109 0.954 . . . . 0.0 109.623 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -108.21 107.26 60.02 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -54.95 75.26 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.991 3.794 . . . . 0.0 116.028 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -65.07 85.04 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.495 1.118 . . . . 0.0 108.522 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -31.43 -58.16 0.25 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 127.234 2.214 . . . . 0.0 113.878 -171.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -57.56 -46.15 84.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.707 -0.621 . . . . 0.0 112.12 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -66.08 -43.22 87.97 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.7 mm -54.06 -53.57 27.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 C-N-CA 123.224 0.61 . . . . 0.0 109.796 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -56.34 -52.04 66.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.188 0.595 . . . . 0.0 110.825 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.02 -58.08 8.66 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.64 -54.21 40.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.149 0.98 . . . . 0.0 110.534 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.9 mt -51.08 -50.82 23.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.46 -46.96 85.53 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.482 0.583 . . . . 0.0 111.712 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -57.68 -45.37 85.69 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.855 0.462 . . . . 0.0 110.995 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.24 -34.86 55.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.633 0.254 . . . . 0.0 110.608 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -78.87 76.6 5.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.78 0.832 . . . . 0.0 110.275 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt . . . . . 0 CA--C 1.535 0.386 0 C-N-CA 123.12 0.568 . . . . 0.0 110.313 172.018 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.971 0 CA-C-O 119.633 -0.537 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.8 p -102.69 175.21 5.57 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 170.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.0 mm -116.09 120.43 64.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 172.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.96 158.41 35.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.478 1.111 . . . . 0.0 110.542 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -48.99 -52.97 21.92 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.075 0.55 . . . . 0.0 111.77 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.8 -38.76 92.28 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 119.006 0.821 . . . . 0.0 111.252 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.5 -49.07 79.03 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.926 -0.483 . . . . 0.0 109.781 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.23 -45.73 83.62 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.578 0.751 . . . . 0.0 110.994 175.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.61 -50.37 68.23 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.773 1.229 . . . . 0.0 108.903 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.7 m -58.4 -48.74 79.68 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.068 0.547 . . . . 0.0 110.404 178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.29 -51.37 64.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.727 0.811 . . . . 0.0 110.187 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.1 mmt . . . . . 0 CA--C 1.529 0.152 0 O-C-N 122.288 -0.257 . . . . 0.0 110.68 175.073 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.439 -1.013 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -43.95 -49.24 8.57 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 123.877 0.871 . . . . 0.0 111.669 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -49.62 -49.77 45.61 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.269 0.628 . . . . 0.0 111.827 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -64.63 -42.89 95.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.76 -0.587 . . . . 0.0 109.981 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -59.91 -39.34 85.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.471 0.578 . . . . 0.0 111.557 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -59.47 -53.94 52.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.508 0.723 . . . . 0.0 109.711 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -53.89 -49.08 69.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 83.6 mt -57.57 -43.51 83.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.125 0.97 . . . . 0.0 109.965 177.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -63.25 -44.56 94.83 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.539 -0.725 . . . . 0.0 111.341 177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -56.67 -50.58 71.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.309 0.504 . . . . 0.0 110.145 175.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.12 -52.26 63.83 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 110.372 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.98 -54.13 16.94 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.879 0.872 . . . . 0.0 110.641 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.5 -51.53 66.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.472 0.709 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -52.8 -53.53 47.05 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.89 -38.16 81.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.887 0.475 . . . . 0.0 111.31 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -73.12 62.48 0.65 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.128 0.422 . . . . 0.0 110.268 174.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 p . . . . . 0 N--CA 1.455 -0.212 0 C-N-CA 123.973 0.909 . . . . 0.0 111.139 179.749 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.863 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.3 p -130.45 138.22 50.19 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.723 1.609 . . . . 0.0 107.546 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.0 mt -79.81 110.92 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.104 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -175.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -60.75 147.22 43.16 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.194 -0.316 . . . . 0.0 110.2 173.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.96 -48.07 1.54 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -59.42 -45.21 92.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.958 0.503 . . . . 0.0 111.29 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -62.22 -38.41 89.08 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.002 -0.436 . . . . 0.0 109.852 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.36 -40.09 93.14 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.653 -0.654 . . . . 0.0 110.91 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -58.45 -47.28 84.52 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.321 -0.862 . . . . 0.0 110.738 171.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.1 t -53.99 -49.11 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 118.433 0.561 . . . . 0.0 109.908 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.66 -56.0 18.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.023 0.529 . . . . 0.0 110.82 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 18.0 mtm -53.45 -49.59 67.07 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.042 0.537 . . . . 0.0 111.264 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.97 -48.04 81.15 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.62 95.51 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.84 0.856 . . . . 0.0 111.247 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.16 -30.76 69.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.579 0.752 . . . . 0.0 110.856 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.14 7.53 10.11 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.627 1.108 . . . . 0.0 112.854 171.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -72.14 167.31 20.54 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.29 1.045 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -105.31 87.16 1.91 Allowed Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.865 1.666 . . . . 0.0 108.706 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.87 73.92 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.543 2.162 . . . . 0.0 112.668 -172.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -64.0 115.25 4.73 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.541 0.737 . . . . 0.0 109.253 172.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -41.51 -47.96 3.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.606 1.562 . . . . 0.0 112.333 -174.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.09 -56.12 16.44 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.62 0.768 . . . . 0.0 110.639 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.07 -44.16 85.3 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.555 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 mm -54.41 -53.83 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.54 0.736 . . . . 0.0 110.4 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -54.8 -52.32 63.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.966 0.507 . . . . 0.0 110.414 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -55.24 -59.98 4.03 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 122.907 0.129 . . . . 0.0 110.693 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.3 ttp -53.89 -54.83 33.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.223 0.609 . . . . 0.0 110.568 -176.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.4 mt -55.45 -50.22 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.25 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -57.86 -44.16 86.41 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.359 0.982 . . . . 0.0 111.89 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.97 -47.32 81.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.67 0.214 . . . . 0.0 110.818 177.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 31.9 mm -74.75 -35.28 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 122.136 -0.352 . . . . 0.0 111.625 -177.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -80.03 46.41 0.8 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.308 1.443 . . . . 0.0 111.909 -169.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.449 -0.514 0 O-C-N 121.599 -0.688 . . . . 0.0 110.5 -173.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.002 0 CA-C-O 119.247 -0.752 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p -125.71 122.8 37.35 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.003 0.902 . . . . 0.0 112.022 -173.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.1 mm -75.32 106.45 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.82 158.72 34.95 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.324 0.583 . . . . 0.0 109.846 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -47.74 -40.12 19.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.013 0.925 . . . . 0.0 112.573 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.65 -47.26 79.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.449 1.022 . . . . 0.0 111.727 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.97 -48.12 80.9 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.521 -0.737 . . . . 0.0 110.136 174.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -55.71 -50.68 69.69 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.09 0.471 . . . . 0.0 110.632 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.2 tp -54.18 -49.1 70.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.864 1.665 . . . . 0.0 109.935 175.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.9 m -57.77 -51.31 70.07 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.893 -0.504 . . . . 0.0 110.527 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 59.8 ttp -55.31 -50.07 70.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.941 0.496 . . . . 0.0 109.869 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.292 0 C-N-CA 123.19 0.596 . . . . 0.0 110.32 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -53.96 -42.97 69.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 171.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -56.21 -49.13 74.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.915 0.486 . . . . 0.0 110.605 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -56.01 -48.97 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.704 0.684 . . . . 0.0 111.139 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -55.73 -44.18 77.3 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.287 0.494 . . . . 0.0 111.238 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -57.68 -52.87 63.67 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.777 0.831 . . . . 0.0 109.791 176.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -56.64 -47.06 80.57 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.983 -0.448 . . . . 0.0 111.314 178.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.59 -46.28 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.307 0.643 . . . . 0.0 109.731 176.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -61.84 -46.45 89.4 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.765 -0.584 . . . . 0.0 111.16 178.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -55.57 -51.44 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.865 -0.522 . . . . 0.0 110.32 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.88 67.75 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.978 0.511 . . . . 0.0 110.433 177.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -49.42 -62.58 1.47 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.126 0.571 . . . . 0.0 110.196 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -52.86 -46.2 67.74 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.472 0.709 . . . . 0.0 111.073 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 tt -56.68 -53.2 60.41 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.676 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -62.29 -37.8 86.89 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.267 0.485 . . . . 0.0 110.979 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -70.91 29.27 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.6 2.36 . . . . 0.0 113.307 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.1 p . . . . . 0 CA--C 1.532 0.257 0 C-N-CA 127.168 2.187 . . . . 0.0 112.051 -176.332 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.702 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.0 p -136.45 123.65 21.77 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.418 0.687 . . . . 0.0 109.327 -173.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -72.08 123.9 27.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.83 147.47 41.12 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.41 -49.04 0.7 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.806 1.242 . . . . 0.0 112.8 171.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -54.2 -54.86 34.07 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.059 0.944 . . . . 0.0 110.926 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -57.84 -41.66 82.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.077 0.551 . . . . 0.0 109.84 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 tp -63.78 -46.78 83.67 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.996 -0.44 . . . . 0.0 111.247 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.257 19.9 ptpt -64.2 -36.11 82.99 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.221 -0.924 . . . . 0.0 111.556 177.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.96 -48.42 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.68 0.673 . . . . 0.0 110.105 171.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.2 -54.48 42.86 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.869 0.467 . . . . 0.0 110.493 177.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.8 mtm -53.88 -45.94 71.21 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.953 0.501 . . . . 0.0 111.43 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.24 -49.3 76.48 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.922 -0.486 . . . . 0.0 110.062 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.38 -40.12 77.48 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.784 0.434 . . . . 0.0 111.093 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.98 2.43 5.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.186 0.995 . . . . 0.0 113.027 174.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.59 18.76 65.34 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.185 0.902 . . . . 0.0 113.229 173.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -75.89 167.28 22.16 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.321 1.061 . . . . 0.0 110.092 172.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -109.52 105.85 57.74 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 169.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -56.86 71.67 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 124.887 3.724 . . . . 0.0 115.912 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -68.36 85.34 0.27 Allowed 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 169.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -31.17 -54.39 0.22 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 127.599 2.359 . . . . 0.0 113.629 -173.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -59.73 -48.73 80.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.814 0.446 . . . . 0.0 110.276 -177.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -64.6 -43.34 94.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.323 0.649 . . . . 0.0 109.68 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 mm -54.04 -52.88 32.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 123.182 0.593 . . . . 0.0 109.904 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -57.94 -48.0 81.24 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.215 0.606 . . . . 0.0 110.812 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.31 -54.94 33.49 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 33.8 ttp -56.44 -52.61 64.02 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.352 0.661 . . . . 0.0 110.361 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.5 mt -48.39 -49.57 12.95 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 123.116 0.566 . . . . 0.0 109.646 176.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -59.11 -49.38 78.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.753 -0.165 . . . . 0.0 111.397 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -56.63 -44.31 81.12 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.898 0.317 . . . . 0.0 111.368 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.0 mm -71.52 -34.96 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.692 0.397 . . . . 0.0 110.572 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -79.24 67.95 5.1 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.694 -0.629 . . . . 0.0 110.872 -174.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm . . . . . 0 CA--C 1.538 0.483 0 C-N-CA 125.342 1.457 . . . . 0.0 113.705 176.949 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.015 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.0 p -157.03 161.95 39.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.6 mm -101.21 106.51 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -65.66 154.82 37.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.092 0.557 . . . . 0.0 109.857 169.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -43.73 -52.06 6.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.592 0.757 . . . . 0.0 112.857 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.43 -34.04 77.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.849 0.75 . . . . 0.0 111.297 -177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -67.95 -42.43 80.96 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.467 -0.77 . . . . 0.0 109.408 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.16 -45.82 90.0 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.058 -0.401 . . . . 0.0 110.446 173.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.13 -47.8 71.49 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.354 1.062 . . . . 0.0 109.025 174.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.1 m -58.2 -49.41 77.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.934 0.494 . . . . 0.0 110.889 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -54.29 -52.71 60.59 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.86 -0.525 . . . . 0.0 110.171 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 123.188 0.595 . . . . 0.0 110.044 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 65.8 p . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.853 0.359 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -52.81 -41.86 64.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.913 0.485 . . . . 0.0 109.889 172.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -54.68 -53.59 52.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.147 0.579 . . . . 0.0 110.578 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -56.1 -45.63 79.38 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 122.04 -0.413 . . . . 0.0 110.851 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -55.8 -47.34 77.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.696 0.68 . . . . 0.0 111.112 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -56.19 -51.01 69.59 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.727 0.411 . . . . 0.0 110.277 176.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.7 -51.18 64.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.881 0.31 . . . . 0.0 110.776 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.22 -42.23 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 123.77 0.828 . . . . 0.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -58.98 -51.16 71.25 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.618 0.767 . . . . 0.0 110.167 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.15 -41.15 97.28 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.311 -0.868 . . . . 0.0 111.54 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.6 -51.76 66.06 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.016 -0.428 . . . . 0.0 110.162 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -50.66 -53.77 28.34 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.556 0.742 . . . . 0.0 110.754 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -52.68 -52.92 53.8 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.264 1.026 . . . . 0.0 110.242 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.84 -51.93 65.79 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.284 0.234 . . . . 0.0 110.854 178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -59.78 -39.41 84.8 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.419 -0.175 . . . . 0.0 110.545 -179.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.82 63.83 0.92 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.471 0.709 . . . . 0.0 109.924 172.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 77.5 p . . . . . 0 CA--C 1.536 0.441 0 C-N-CA 123.822 0.849 . . . . 0.0 111.331 171.14 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.084 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -150.06 121.27 7.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.025 1.33 . . . . 0.0 108.45 -169.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.0 mt -81.56 114.66 22.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.16 148.33 50.23 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.906 0.775 . . . . 0.0 110.307 171.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.88 -47.99 1.1 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.053 0.941 . . . . 0.0 113.142 173.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -58.92 -46.52 87.72 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.148 0.579 . . . . 0.0 111.228 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -61.82 -41.18 97.47 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.74 -45.25 93.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.599 0.636 . . . . 0.0 110.492 176.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -54.93 -50.18 69.48 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.702 -0.624 . . . . 0.0 110.233 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.33 -48.19 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.062 0.392 . . . . 0.0 110.542 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.72 -54.83 32.44 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.197 0.599 . . . . 0.0 110.458 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.6 mtm -56.03 -42.43 76.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.831 0.852 . . . . 0.0 110.992 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -60.56 -45.51 93.61 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.834 -0.541 . . . . 0.0 110.621 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.86 -37.99 84.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.533 0.733 . . . . 0.0 111.138 175.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.0 mt -68.22 -0.42 4.67 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.949 0.899 . . . . 0.0 112.121 171.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.5 13.94 66.82 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.786 1.184 . . . . 0.0 112.399 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -79.46 161.96 25.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.291 1.045 . . . . 0.0 109.825 -176.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -105.45 93.82 7.52 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -68.46 83.87 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.133 1.888 . . . . 0.0 112.353 -173.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -60.07 90.2 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.894 1.278 . . . . 0.0 110.041 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -31.37 -59.55 0.24 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 127.353 2.261 . . . . 0.0 114.051 -170.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.4 -47.68 83.1 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.641 0.655 . . . . 0.0 111.795 -176.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -65.8 -41.41 91.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.3 mm -56.69 -50.84 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 122.794 0.438 . . . . 0.0 110.285 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -60.08 -45.34 93.26 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.441 0.564 . . . . 0.0 111.155 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -53.93 -56.62 16.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.24 0.473 . . . . 0.0 110.282 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.9 ttp -54.42 -53.45 53.99 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.978 0.511 . . . . 0.0 110.81 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.5 mt -49.66 -49.54 19.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 123.512 0.725 . . . . 0.0 109.455 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -59.13 -46.22 88.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.342 0.519 . . . . 0.0 111.522 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.12 -42.95 86.9 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.648 0.379 . . . . 0.0 111.448 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.3 mm -74.79 -34.84 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 122.049 -0.407 . . . . 0.0 111.032 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -78.36 80.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.827 0.851 . . . . 0.0 110.63 -173.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 123.556 0.742 . . . . 0.0 110.878 174.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.841 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.3 p -110.49 176.55 5.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.321 0.648 . . . . 0.0 109.543 175.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.1 mm -114.79 114.96 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.986 1.714 . . . . 0.0 106.93 169.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.49 160.08 32.1 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.552 1.141 . . . . 0.0 110.534 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -52.73 -52.07 57.82 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.842 0.457 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.69 -44.72 90.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.322 0.51 . . . . 0.0 110.873 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -56.93 -51.01 70.84 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.82 -48.37 78.14 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.165 0.586 . . . . 0.0 111.287 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -58.83 -45.42 90.04 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 121.804 -0.56 . . . . 0.0 110.0 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.9 m -59.21 -52.24 66.53 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 122.083 -0.385 . . . . 0.0 110.292 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 21.2 ttt -49.21 -55.26 13.07 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.911 0.884 . . . . 0.0 109.982 175.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 44.0 tpp . . . . . 0 N--CA 1.451 -0.387 0 C-N-CA 123.538 0.735 . . . . 0.0 110.211 -178.766 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.452 -0.367 0 CA-C-O 120.974 0.416 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -50.2 -46.91 54.83 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.942 0.497 . . . . 0.0 110.105 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -43.45 -56.29 3.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.165 1.386 . . . . 0.0 111.701 170.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -65.17 -39.75 93.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 121.962 -0.461 . . . . 0.0 110.158 -177.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -60.76 -40.49 92.67 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.647 -0.658 . . . . 0.0 111.088 175.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -57.72 -51.52 69.19 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.787 -0.571 . . . . 0.0 109.838 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.19 -48.11 68.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.064 0.393 . . . . 0.0 111.208 177.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 87.0 mt -57.93 -46.15 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 123.769 0.828 . . . . 0.0 110.042 177.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -60.44 -46.24 90.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.712 0.687 . . . . 0.0 111.014 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -57.69 -52.1 66.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.778 0.431 . . . . 0.0 110.325 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -50.21 69.94 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.746 0.418 . . . . 0.0 110.513 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -51.48 -54.9 22.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.541 0.736 . . . . 0.0 110.722 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -55.22 -49.34 72.22 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.759 0.824 . . . . 0.0 110.562 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 tt -56.06 -52.48 64.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.666 0.212 . . . . 0.0 110.656 178.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -60.13 -42.6 95.16 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.597 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -74.56 64.67 1.21 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.893 0.877 . . . . 0.0 109.735 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 123.628 0.771 . . . . 0.0 111.923 174.675 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.279 0 CA-C-O 119.716 -0.491 . . . . 0.0 114.276 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.8 p -150.09 122.44 8.43 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.03 1.332 . . . . 0.0 109.086 -174.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -80.77 111.08 17.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -63.07 147.62 50.21 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.89 -46.81 1.35 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.507 1.123 . . . . 0.0 113.242 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.4 -48.14 82.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.959 0.504 . . . . 0.0 110.985 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -61.21 -41.52 97.0 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.43 -44.19 95.3 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.939 -0.476 . . . . 0.0 110.299 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -56.42 -49.21 75.2 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.664 -0.648 . . . . 0.0 110.482 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.9 t -54.32 -49.09 66.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.51 -56.46 16.8 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.868 0.467 . . . . 0.0 110.735 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 48.5 mtm -56.05 -44.02 78.44 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.497 0.719 . . . . 0.0 111.487 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -58.11 -51.5 69.45 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.43 78.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.342 0.657 . . . . 0.0 111.474 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -67.55 -10.89 56.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.456 1.103 . . . . 0.0 112.061 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.83 9.41 54.45 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.346 0.974 . . . . 0.0 113.242 172.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -74.15 165.35 25.31 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.7 1.25 . . . . 0.0 109.938 176.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -104.08 92.49 4.59 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.73 77.13 3.09 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 121.786 1.657 . . . . 0.0 112.384 -170.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -60.74 97.42 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.45 1.1 . . . . 0.0 110.124 173.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -31.76 -51.99 0.23 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.691 2.397 . . . . 0.0 113.903 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -58.47 -56.26 24.48 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.089 0.555 . . . . 0.0 111.441 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.71 -42.64 99.75 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.2 mm -58.25 -49.28 82.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 122.976 0.511 . . . . 0.0 110.638 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -57.63 -48.41 79.52 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.393 0.677 . . . . 0.0 109.911 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -53.73 -57.42 10.91 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -54.48 -54.01 46.63 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 110.885 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.5 mt -50.28 -47.26 25.72 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.3 0.64 . . . . 0.0 109.896 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.0 m -62.15 -42.31 99.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.086 0.403 . . . . 0.0 111.604 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.35 -47.11 86.67 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.4 0.546 . . . . 0.0 111.153 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.64 -34.71 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 122.204 -0.31 . . . . 0.0 110.947 -177.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -85.55 92.34 8.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.804 0.841 . . . . 0.0 110.104 -176.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.3 tptt . . . . . 0 CA--C 1.539 0.519 0 C-N-CA 124.686 1.195 . . . . 0.0 112.979 176.371 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.865 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.8 p -140.49 128.68 22.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.529 1.132 . . . . 0.0 109.496 -175.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.4 mm -95.24 108.76 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.67 159.48 34.36 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -51.28 -51.29 55.55 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 121.901 -0.499 . . . . 0.0 111.959 -178.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -53.72 -46.36 70.76 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.933 0.397 . . . . 0.0 111.029 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.48 -47.62 83.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.901 0.48 . . . . 0.0 109.864 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -54.97 -53.2 58.8 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.149 0.58 . . . . 0.0 110.47 176.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -55.18 -47.02 75.79 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.278 0.631 . . . . 0.0 110.001 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.5 m -57.51 -49.73 75.36 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.229 -0.294 . . . . 0.0 110.564 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 53.8 ttp -55.19 -52.75 62.34 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.214 0.606 . . . . 0.0 110.302 178.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 93.6 mmm . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 122.859 0.463 . . . . 0.0 110.134 177.501 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -47.43 -43.99 24.38 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.364 0.665 . . . . 0.0 111.081 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -56.37 -42.94 78.65 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 122.033 -0.417 . . . . 0.0 111.656 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -63.81 -45.36 89.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -55.08 -48.37 73.63 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.093 0.406 . . . . 0.0 110.602 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -55.64 -53.02 61.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.945 0.898 . . . . 0.0 110.139 177.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -53.33 -47.6 69.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 110.945 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.13 -41.86 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.906 -0.496 . . . . 0.0 110.356 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -45.6 92.05 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.562 -0.711 . . . . 0.0 110.172 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -55.87 -52.75 62.98 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.359 -0.838 . . . . 0.0 110.44 176.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.65 -50.47 68.08 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.254 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -50.02 -55.7 13.68 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.322 0.649 . . . . 0.0 110.442 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -54.49 -51.52 64.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 110.629 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.2 -52.09 66.73 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.452 0.168 . . . . 0.0 110.938 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.01 -30.87 71.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.308 -0.245 . . . . 0.0 111.407 -178.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -76.31 47.18 0.45 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.833 1.253 . . . . 0.0 109.586 173.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.395 0 C-N-CA 125.646 1.579 . . . . 0.0 111.626 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.569 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -141.96 135.39 29.32 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.44 0.696 . . . . 0.0 109.877 -172.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 81.2 mt -74.35 112.49 11.47 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.081 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -176.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.26 146.13 48.94 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.566 0.621 . . . . 0.0 109.952 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.17 -47.77 1.19 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.758 0.823 . . . . 0.0 112.803 172.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.61 -45.36 89.36 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 111.376 177.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.1 -38.93 93.13 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.964 -0.46 . . . . 0.0 110.032 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.49 -40.23 92.83 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.725 -0.61 . . . . 0.0 110.502 176.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 tmmm? -57.29 -49.07 77.24 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.481 -0.762 . . . . 0.0 110.562 172.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.1 -50.03 47.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 118.62 0.646 . . . . 0.0 110.385 173.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.31 -55.11 27.34 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.525 0.73 . . . . 0.0 110.602 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 68.7 mtm -56.66 -41.4 77.16 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.337 0.655 . . . . 0.0 111.126 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.94 49.94 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 174.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.25 -40.2 81.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.556 0.742 . . . . 0.0 111.447 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.5 mt -68.16 -3.66 11.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.168 0.987 . . . . 0.0 112.312 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.58 24.25 56.62 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 119.372 0.987 . . . . 0.0 112.317 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.24 172.86 11.05 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -118.22 101.52 51.3 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -55.35 73.34 0.03 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 124.578 3.518 . . . . 0.0 116.704 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -68.99 90.73 0.45 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 169.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -31.61 -49.08 0.16 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.327 2.251 . . . . 0.0 113.197 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.41 -58.66 6.34 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.807 0.843 . . . . 0.0 110.758 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -67.16 -42.86 83.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.786 0.834 . . . . 0.0 109.696 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 12.3 mm -52.2 -56.11 7.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 123.568 0.747 . . . . 0.0 109.652 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.67 -51.36 69.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.342 0.657 . . . . 0.0 110.694 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -53.7 -57.19 11.74 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.806 0.275 . . . . 0.0 110.44 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.93 -53.71 52.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.581 0.752 . . . . 0.0 110.551 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 51.7 mt -50.32 -49.6 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 110.154 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -59.65 -47.28 86.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.031 0.378 . . . . 0.0 111.153 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -57.31 -44.73 84.39 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.6 0.36 . . . . 0.0 111.11 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -71.33 -34.08 52.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 O-C-N 122.196 -0.315 . . . . 0.0 110.885 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -73.63 72.51 1.45 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.028 0.931 . . . . 0.0 110.679 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 123.16 0.584 . . . . 0.0 111.066 173.884 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.86 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -105.43 163.64 12.48 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 117.306 0.553 . . . . 0.0 109.527 169.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.4 mm -120.37 115.31 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.101 1.761 . . . . 0.0 106.709 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -73.51 160.86 31.08 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.315 1.046 . . . . 0.0 110.512 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -49.31 -45.0 44.71 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.328 0.651 . . . . 0.0 111.97 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.5 -46.79 88.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.954 0.797 . . . . 0.0 110.927 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -61.64 -46.8 88.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.92 0.488 . . . . 0.0 109.733 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.06 -48.99 79.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.095 0.558 . . . . 0.0 110.637 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.31 -45.19 76.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.928 0.891 . . . . 0.0 109.918 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.0 m -57.26 -51.67 68.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.873 0.306 . . . . 0.0 110.274 175.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -53.56 -52.13 60.71 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.61 0.364 . . . . 0.0 110.711 177.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.7 mmm . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 123.088 0.555 . . . . 0.0 111.014 -179.22 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.4 p . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -53.44 -34.92 59.7 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.078 0.551 . . . . 0.0 110.971 170.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -64.26 -51.47 63.4 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.226 -0.921 . . . . 0.0 109.857 176.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -55.3 -45.96 76.24 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.278 -0.264 . . . . 0.0 110.416 175.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.42 -39.61 88.04 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.519 -0.738 . . . . 0.0 111.746 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -58.82 -47.76 83.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.16 0.891 . . . . 0.0 111.025 171.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -57.3 -47.3 81.85 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.998 -0.439 . . . . 0.0 110.657 177.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.51 -43.37 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.029 0.931 . . . . 0.0 109.926 178.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -56.8 -51.92 67.06 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.571 0.623 . . . . 0.0 110.323 172.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -53.85 -53.15 56.47 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.649 0.658 . . . . 0.0 110.876 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -50.84 68.68 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.89 0.476 . . . . 0.0 110.654 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -52.64 -53.21 50.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.895 0.878 . . . . 0.0 110.331 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.0 -51.34 68.09 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.443 1.097 . . . . 0.0 110.526 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.38 -51.75 68.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.441 0.162 . . . . 0.0 110.661 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.18 -37.71 81.04 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.823 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -74.59 57.88 0.76 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.663 0.744 . . . . 0.0 109.156 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.41 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -178.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.15 0 N-CA-C 112.073 -0.411 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.3 p -154.46 134.84 13.34 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.808 -1.923 . . . . 0.0 105.808 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -85.99 105.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 169.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.22 149.35 41.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.07 -48.62 1.23 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.867 1.267 . . . . 0.0 112.881 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -57.86 -48.15 80.64 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.844 0.458 . . . . 0.0 111.033 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.77 -39.24 93.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.878 0.471 . . . . 0.0 110.128 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 tp -63.44 -41.91 98.66 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.818 -0.551 . . . . 0.0 109.869 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -59.37 -47.87 83.78 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.749 -0.594 . . . . 0.0 110.452 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.8 t -51.94 -52.02 25.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.489 0.586 . . . . 0.0 110.153 173.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.38 -53.12 55.68 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 123.246 0.619 . . . . 0.0 110.765 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.43 -40.05 85.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.443 0.697 . . . . 0.0 111.54 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.26 -51.65 68.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 172.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.96 -38.11 75.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.848 -0.533 . . . . 0.0 111.841 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -71.58 -1.58 14.03 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.419 1.088 . . . . 0.0 112.183 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 73.12 29.82 64.01 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 119.032 0.833 . . . . 0.0 112.009 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -81.55 169.73 16.73 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 117.586 0.693 . . . . 0.0 109.158 173.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 mp0 -110.54 103.42 54.19 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.808 1.243 . . . . 0.0 107.76 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -57.36 74.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.308 3.338 . . . . 0.0 115.874 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -66.15 85.26 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 169.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -31.45 -55.5 0.26 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.048 2.139 . . . . 0.0 114.031 -172.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.2 -49.1 79.13 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.883 -0.51 . . . . 0.0 111.368 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -62.86 -43.68 98.14 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.306 0.642 . . . . 0.0 109.505 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.2 mm -55.44 -53.47 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.46 0.704 . . . . 0.0 109.863 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.8 -50.93 69.15 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.556 0.342 . . . . 0.0 110.951 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -53.67 -55.5 25.47 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.39 -54.19 43.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.569 0.748 . . . . 0.0 110.732 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.8 mt -51.44 -47.29 35.75 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 -48.1 82.97 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.042 0.383 . . . . 0.0 111.298 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.26 -42.73 77.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.67 0.388 . . . . 0.0 111.178 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.8 mm -76.7 -35.17 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-N 118.068 0.395 . . . . 0.0 111.636 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -85.12 92.78 8.47 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.663 -0.648 . . . . 0.0 111.004 -171.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.897 1.279 . . . . 0.0 113.571 177.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.039 0 CA-C-O 119.4 -0.667 . . . . 0.0 114.45 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.2 p -142.33 136.06 29.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.062 0.931 . . . . 0.0 109.589 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.4 mm -102.16 112.38 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -71.5 158.11 36.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.32 0.648 . . . . 0.0 109.924 170.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.54 -48.65 48.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.559 0.743 . . . . 0.0 112.398 177.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.7 -42.83 89.51 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.25 -0.281 . . . . 0.0 110.266 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -64.82 -46.11 83.36 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.839 0.456 . . . . 0.0 110.118 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.86 -52.71 61.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.921 0.888 . . . . 0.0 110.291 176.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.16 -48.0 79.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.172 0.589 . . . . 0.0 110.028 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.9 m -57.64 -46.54 84.03 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.805 -0.559 . . . . 0.0 110.793 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 55.6 ttp -53.16 -42.98 66.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.672 0.789 . . . . 0.0 110.465 177.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 177.016 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 38.3 p . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.0 mp0 -55.62 -35.81 66.27 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.012 -0.43 . . . . 0.0 109.961 170.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -68.86 -45.09 71.95 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.537 -0.727 . . . . 0.0 109.969 -179.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.24 -49.74 71.23 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.336 0.516 . . . . 0.0 110.135 171.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -57.79 -47.36 82.78 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.908 -0.495 . . . . 0.0 110.898 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.04 -59.5 4.46 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.278 0.631 . . . . 0.0 110.445 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -48.13 -50.55 28.27 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.924 0.89 . . . . 0.0 111.098 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.86 -45.06 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 122.745 0.418 . . . . 0.0 110.2 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -45.91 90.41 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.779 0.718 . . . . 0.0 110.908 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -49.68 76.77 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.545 -0.722 . . . . 0.0 110.469 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.05 -48.1 73.91 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.989 0.423 . . . . 0.0 110.23 176.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -53.33 -53.33 52.57 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.512 0.725 . . . . 0.0 110.651 176.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -54.54 -50.76 67.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.439 1.096 . . . . 0.0 110.078 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.26 -53.02 62.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -61.15 -37.05 81.49 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.065 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -74.41 60.66 0.87 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.41 0.684 . . . . 0.0 109.925 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 76.4 p . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 124.202 1.001 . . . . 0.0 110.819 173.507 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.006 0 N-CA-C 111.926 -0.469 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.9 p -158.76 136.63 10.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.032 -1.84 . . . . 0.0 106.032 -169.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 88.4 mt -88.12 114.98 27.58 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 174.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -62.88 146.15 53.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.644 1.111 . . . . 0.0 109.777 173.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.95 -45.48 1.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.04 0.836 . . . . 0.0 113.022 173.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.46 -46.62 88.25 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.821 -0.549 . . . . 0.0 111.165 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.01 -38.59 86.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.934 -0.479 . . . . 0.0 110.13 176.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.14 -43.2 99.35 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.809 -0.557 . . . . 0.0 110.277 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -58.54 -46.22 87.29 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.563 -0.71 . . . . 0.0 110.644 176.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.33 -45.86 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 O-C-N 122.051 -0.406 . . . . 0.0 110.498 173.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.14 -52.55 62.92 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.775 -0.578 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.02 -42.2 89.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.54 0.736 . . . . 0.0 111.347 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -55.31 -49.76 71.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.866 -0.521 . . . . 0.0 110.335 172.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.8 -38.72 86.31 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.142 0.577 . . . . 0.0 111.34 178.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 mt -68.87 -2.47 9.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.292 1.037 . . . . 0.0 112.052 173.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.4 25.49 70.36 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 119.019 0.827 . . . . 0.0 111.978 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.67 165.55 21.9 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -107.11 106.95 59.69 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 169.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -58.87 73.66 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.865 3.044 . . . . 0.0 115.096 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.96 96.3 0.59 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.492 -0.755 . . . . 0.0 109.013 173.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -31.2 -60.31 0.21 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 127.543 2.337 . . . . 0.0 114.081 -172.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -58.02 -54.76 43.25 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.09 -41.76 93.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.695 0.798 . . . . 0.0 110.447 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.8 mm -56.33 -55.61 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.135 0.574 . . . . 0.0 109.938 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -57.7 -46.02 84.91 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 122.379 -0.2 . . . . 0.0 110.84 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -55.19 -57.84 10.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.819 0.448 . . . . 0.0 109.903 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.4 ttp -54.41 -53.6 51.98 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.296 0.638 . . . . 0.0 110.233 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.33 -50.29 28.16 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.59 -44.09 89.72 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.819 0.736 . . . . 0.0 111.913 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -59.52 -39.97 85.62 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.953 -0.467 . . . . 0.0 111.386 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -80.72 -34.56 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 118.136 0.425 . . . . 0.0 111.743 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -85.86 87.61 7.44 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.163 0.985 . . . . 0.0 110.903 -169.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? . . . . . 0 CA--C 1.533 0.304 0 C-N-CA 123.889 0.876 . . . . 0.0 110.586 174.779 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.004 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.6 p -108.03 -179.88 4.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 169.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.7 mm -122.14 119.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -74.96 158.83 32.63 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.087 0.955 . . . . 0.0 110.208 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -50.82 -47.57 60.04 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.614 0.366 . . . . 0.0 111.703 178.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.09 -45.29 87.44 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.128 0.49 . . . . 0.0 110.535 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -62.77 -46.49 87.76 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.976 0.51 . . . . 0.0 110.017 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -58.37 -48.71 79.72 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.94 0.496 . . . . 0.0 110.671 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.61 -49.05 73.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.691 0.796 . . . . 0.0 109.743 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.9 m -55.98 -49.74 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 117.957 0.344 . . . . 0.0 110.499 178.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.4 ttp -54.32 -53.86 48.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.01 0.524 . . . . 0.0 110.498 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.1 mmt . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 110.523 -0.177 . . . . 0.0 110.523 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 121.03 0.443 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -54.44 -42.12 70.22 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 172.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -52.67 -55.3 23.54 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.797 0.839 . . . . 0.0 109.858 175.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -53.86 -50.49 66.15 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 119.117 -0.468 . . . . 0.0 110.843 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.86 -47.61 73.98 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.738 0.699 . . . . 0.0 111.268 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -57.95 -50.32 73.76 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.008 0.523 . . . . 0.0 110.855 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -58.5 -47.28 84.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.111 0.414 . . . . 0.0 111.118 178.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.77 -41.59 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -62.41 -47.48 83.92 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.64 -0.663 . . . . 0.0 110.948 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -53.97 -53.47 52.35 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.91 -49.25 69.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.99 0.516 . . . . 0.0 110.466 177.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -52.49 -57.64 9.27 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.354 0.662 . . . . 0.0 110.994 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -56.86 -47.53 80.2 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.943 0.497 . . . . 0.0 110.402 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.8 tt -54.92 -53.74 51.61 Favored 'General case' 0 C--N 1.338 0.074 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -60.01 -37.78 80.75 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.172 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -73.75 61.88 0.78 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.703 0.683 . . . . 0.0 109.601 169.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 57.0 p . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.664 1.186 . . . . 0.0 111.158 -179.794 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.027 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -130.76 147.04 52.37 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.914 2.086 . . . . 0.0 108.26 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.92 119.95 27.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.46 144.6 57.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.581 1.082 . . . . 0.0 110.1 173.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.03 -48.79 1.23 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -62.5 -43.51 98.65 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.722 -0.611 . . . . 0.0 110.945 179.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -60.17 -40.32 89.5 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.944 -0.473 . . . . 0.0 109.979 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -63.06 -43.91 97.29 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.786 -0.571 . . . . 0.0 110.223 175.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -57.48 -48.51 79.02 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.479 -0.763 . . . . 0.0 110.744 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.6 t -53.68 -50.58 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.781 0.433 . . . . 0.0 110.327 172.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.58 -53.19 49.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.117 0.567 . . . . 0.0 110.543 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 69.7 mtm -60.18 -42.71 95.58 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.356 0.662 . . . . 0.0 111.188 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -58.38 6.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.14 82.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.908 0.883 . . . . 0.0 112.19 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.94 -16.5 59.47 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.723 1.209 . . . . 0.0 111.76 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.32 24.47 12.49 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 118.637 0.653 . . . . 0.0 112.334 175.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -80.57 176.79 9.48 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -115.39 97.81 49.25 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -60.98 66.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.249 3.299 . . . . 0.0 116.684 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.64 104.99 1.13 Allowed 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.35 -0.844 . . . . 0.0 109.071 171.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -42.49 -46.83 4.94 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.525 1.53 . . . . 0.0 114.139 -170.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -59.72 -57.56 12.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.29 0.496 . . . . 0.0 110.37 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -58.32 -44.97 88.89 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.712 0.805 . . . . 0.0 109.929 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -53.43 -57.83 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.569 0.747 . . . . 0.0 110.18 175.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -57.72 -47.3 82.79 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.067 0.394 . . . . 0.0 111.097 -178.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -55.12 -58.2 8.65 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 52.7 ttp -56.1 -52.24 65.03 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.842 0.457 . . . . 0.0 110.567 -178.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 39.3 mt -49.79 -51.18 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.1 m -57.53 -49.72 75.42 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.173 0.442 . . . . 0.0 111.477 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -56.88 -43.53 81.37 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 117.838 0.29 . . . . 0.0 111.467 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 mm -71.59 -34.78 53.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 122.01 -0.431 . . . . 0.0 110.673 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -78.9 71.4 5.36 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.481 0.713 . . . . 0.0 111.682 -169.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 123.303 0.641 . . . . 0.0 111.845 176.021 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.887 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -102.78 175.94 5.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.9 mm -128.33 118.44 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 175.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -77.36 170.01 17.3 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.5 0.667 . . . . 0.0 111.221 177.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.44 -36.25 73.37 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.624 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -69.43 -50.17 48.25 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.439 0.563 . . . . 0.0 109.706 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -54.11 -50.2 67.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.914 0.886 . . . . 0.0 109.92 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -56.53 -54.85 41.09 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.958 0.503 . . . . 0.0 110.747 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.08 -47.24 68.69 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.601 0.76 . . . . 0.0 110.128 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 m -56.23 -52.05 65.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.619 0.368 . . . . 0.0 110.343 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 47.5 ttp -55.2 -56.82 15.64 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.0 mmm . . . . . 0 N--CA 1.455 -0.2 0 C-N-CA 122.869 0.468 . . . . 0.0 110.28 -177.576 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 p . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.902 0.382 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -57.55 -41.49 81.07 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 121.688 -0.632 . . . . 0.0 109.666 169.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.6 mp0 -55.18 -52.87 61.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.518 0.727 . . . . 0.0 109.973 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -55.41 -51.1 67.98 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.921 -0.487 . . . . 0.0 111.141 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.33 -41.93 90.25 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.711 0.687 . . . . 0.0 111.646 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -57.89 -53.63 56.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.114 1.366 . . . . 0.0 110.072 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -53.75 -48.7 69.44 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.234 0.614 . . . . 0.0 110.59 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.4 mt -60.35 -42.07 89.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 122.828 0.451 . . . . 0.0 110.276 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -61.35 -45.63 93.58 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.593 0.633 . . . . 0.0 110.851 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -58.04 -50.72 72.45 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.47 0.577 . . . . 0.0 110.672 177.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.55 -52.54 61.75 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -48.08 -60.15 2.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.532 0.733 . . . . 0.0 109.877 175.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -51.31 -49.18 61.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.321 1.048 . . . . 0.0 110.825 -177.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.86 -52.64 64.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.703 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -61.51 -36.37 80.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.172 0.442 . . . . 0.0 111.506 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -72.74 31.68 0.06 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.313 2.245 . . . . 0.0 113.071 -173.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.2 p . . . . . 0 CA--C 1.528 0.127 0 C-N-CA 127.512 2.325 . . . . 0.0 111.796 -173.39 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.707 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 p -135.69 120.96 19.04 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 117.788 0.794 . . . . 0.0 110.239 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.7 mt -72.89 114.12 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.18 147.38 51.07 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.203 0.456 . . . . 0.0 110.216 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.47 -47.85 0.92 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.053 0.941 . . . . 0.0 113.178 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -58.36 -49.26 77.84 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.927 0.491 . . . . 0.0 111.168 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -59.08 -42.75 91.18 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.29 -42.34 99.27 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.966 -0.458 . . . . 0.0 110.902 177.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.02 -47.91 83.9 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.335 -0.853 . . . . 0.0 110.445 176.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.4 t -54.62 -48.62 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 173.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -53.27 55.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.862 0.465 . . . . 0.0 110.584 177.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mtm -57.95 -42.65 85.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.271 0.628 . . . . 0.0 111.599 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -56.57 -52.07 66.2 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.512 0.596 . . . . 0.0 110.116 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.49 75.57 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 122.093 -0.38 . . . . 0.0 111.64 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -72.28 -2.49 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.863 1.265 . . . . 0.0 112.355 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.49 20.94 61.07 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 119.235 0.925 . . . . 0.0 113.362 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -83.36 159.68 21.8 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.259 1.029 . . . . 0.0 109.763 171.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -104.43 98.75 15.2 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 169.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.36 80.47 1.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.357 2.038 . . . . 0.0 112.15 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -59.79 90.54 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.213 1.405 . . . . 0.0 109.518 170.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -32.39 -51.7 0.27 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.058 2.143 . . . . 0.0 115.207 -171.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -60.15 -51.31 70.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.822 0.737 . . . . 0.0 110.535 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -62.79 -41.11 99.13 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.0 mm -59.16 -47.86 88.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.936 0.494 . . . . 0.0 110.562 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.67 -48.17 81.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.852 0.751 . . . . 0.0 110.453 177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -54.7 -58.06 9.01 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -48.35 -59.61 3.32 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.421 1.488 . . . . 0.0 110.713 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.7 mt -51.38 -49.27 32.2 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 C-N-CA 123.472 0.709 . . . . 0.0 109.907 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.2 m -60.06 -47.1 87.28 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.582 0.628 . . . . 0.0 111.592 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.8 -45.49 85.99 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.483 0.313 . . . . 0.0 110.885 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.0 mm -71.65 -35.6 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 111.168 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -82.2 75.25 9.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.54 -0.725 . . . . 0.0 110.507 -170.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp . . . . . 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 0.0 113.11 172.857 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.133 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p -136.1 150.01 48.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.93 0.892 . . . . 0.0 108.931 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.3 mm -109.11 110.24 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 125.006 1.322 . . . . 0.0 108.102 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.21 152.09 45.58 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 171.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.7 -44.77 13.81 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -59.5 -46.8 87.8 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.489 0.586 . . . . 0.0 110.921 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -62.84 -45.95 90.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.019 0.528 . . . . 0.0 109.731 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -56.48 -50.81 70.65 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 123.7 0.8 . . . . 0.0 110.628 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.98 -46.91 84.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.723 0.809 . . . . 0.0 109.709 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.1 m -56.54 -53.7 54.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 117.832 0.287 . . . . 0.0 110.346 177.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -51.33 -53.96 31.0 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.095 0.958 . . . . 0.0 110.053 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 N--CA 1.449 -0.523 0 C-N-CA 123.024 0.53 . . . . 0.0 110.411 -176.421 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -56.06 -37.82 69.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.418 -0.801 . . . . 0.0 110.654 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -56.41 -53.66 54.82 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.169 0.588 . . . . 0.0 110.415 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -55.65 -44.87 77.59 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 175.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -53.59 -43.72 68.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.875 0.47 . . . . 0.0 111.243 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -58.26 -53.23 60.61 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -55.26 -44.35 75.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.543 0.211 . . . . 0.0 111.22 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.47 -45.31 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.016 0.926 . . . . 0.0 109.8 178.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -57.45 -52.47 65.24 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.283 0.492 . . . . 0.0 110.604 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -54.45 -50.84 66.75 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.483 -0.761 . . . . 0.0 111.221 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.8 72.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.195 0.598 . . . . 0.0 110.559 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -52.41 -53.68 41.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.704 0.801 . . . . 0.0 110.311 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -56.49 -50.65 71.16 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.254 0.621 . . . . 0.0 110.211 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.1 tt -57.18 -52.23 66.16 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -60.45 -39.07 86.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.113 0.165 . . . . 0.0 110.595 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -74.25 58.14 0.7 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 C-N-CA 124.343 1.057 . . . . 0.0 110.684 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.125 0 N-CA-C 112.427 -0.269 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.1 p -158.18 143.65 16.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 -169.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.7 mt -87.89 110.81 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.07 147.28 44.33 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.459 1.027 . . . . 0.0 110.324 175.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.43 -48.54 1.96 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.907 0.776 . . . . 0.0 113.037 173.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -59.3 -45.93 89.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.836 0.454 . . . . 0.0 110.996 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.22 -36.59 82.44 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.992 -0.442 . . . . 0.0 110.517 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.89 -41.89 90.97 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.651 -0.655 . . . . 0.0 110.069 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -57.89 -49.45 76.67 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.738 -0.601 . . . . 0.0 110.294 173.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 38.5 t -51.98 -51.37 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.066 0.394 . . . . 0.0 110.16 173.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -55.9 21.97 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.721 0.808 . . . . 0.0 110.743 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.6 mtm -54.84 -45.72 74.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.36 0.664 . . . . 0.0 110.99 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -58.22 -48.01 81.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.756 -0.59 . . . . 0.0 110.444 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.16 79.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.978 0.511 . . . . 0.0 111.35 176.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -70.1 -0.47 7.77 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.532 1.133 . . . . 0.0 112.222 174.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.81 16.76 62.87 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-N 119.117 0.872 . . . . 0.0 112.771 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -75.93 162.05 28.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.267 1.033 . . . . 0.0 109.436 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -108.19 105.77 57.21 Favored Pre-proline 0 N--CA 1.449 -0.506 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -56.13 78.5 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.312 3.341 . . . . 0.0 115.253 -178.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.35 81.37 0.09 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.161 0.984 . . . . 0.0 108.933 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -31.72 -56.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 127.329 2.252 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.98 -50.89 67.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.971 0.415 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.65 -40.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.07 0.548 . . . . 0.0 109.692 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.1 mm -53.64 -54.78 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -56.09 -52.67 63.46 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.673 0.789 . . . . 0.0 109.775 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -52.44 -57.86 8.54 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.897 0.479 . . . . 0.0 110.308 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -51.76 -54.46 28.34 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.8 0.84 . . . . 0.0 110.582 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.4 mt -51.61 -49.67 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -57.06 -48.1 79.37 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.056 0.389 . . . . 0.0 111.419 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -58.96 -42.35 89.68 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.94 0.337 . . . . 0.0 111.094 178.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.06 -31.32 44.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 O-C-N 122.156 -0.34 . . . . 0.0 111.231 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.37 75.74 0.54 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.855 0.862 . . . . 0.0 111.635 -173.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? . . . . . 0 N--CA 1.447 -0.58 0 C-N-CA 125.907 1.683 . . . . 0.0 109.848 171.152 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.194 0 CA-C-O 119.462 -0.632 . . . . 0.0 113.252 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 p -113.99 171.8 7.38 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.138 0.969 . . . . 0.0 108.815 169.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.6 mm -112.05 116.22 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 169.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.96 156.54 39.49 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.429 0.692 . . . . 0.0 109.783 174.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -51.99 -43.45 63.62 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.904 -0.497 . . . . 0.0 111.728 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -57.45 -46.38 83.68 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.354 0.524 . . . . 0.0 110.66 178.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.15 -47.42 82.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.753 0.421 . . . . 0.0 110.113 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -57.02 -51.71 68.16 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.691 0.758 . . . . 0.0 110.304 178.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.2 tp -52.87 -46.27 67.8 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.957 0.903 . . . . 0.0 110.044 174.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 59.2 m -58.3 -47.85 82.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.319 0.509 . . . . 0.0 111.192 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 77.5 mtp -53.26 -51.29 62.71 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.695 0.679 . . . . 0.0 109.827 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.862 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 29.3 m -75.8 129.41 37.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 159.81 154.63 7.37 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.8 mt -121.8 94.37 4.29 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.475 1.51 . . . . 0.0 109.895 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 158.4 26.43 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 171.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -45.37 -45.51 12.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.907 0.883 . . . . 0.0 111.863 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -55.95 -47.44 77.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.908 0.483 . . . . 0.0 110.834 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -61.99 -43.97 97.71 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.24 -44.11 92.35 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.233 -0.292 . . . . 0.0 110.849 178.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -57.86 -51.78 68.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.209 0.604 . . . . 0.0 110.006 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -52.96 -50.23 64.51 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.128 0.422 . . . . 0.0 111.058 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.76 -46.09 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 124.023 0.929 . . . . 0.0 110.377 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -61.17 -49.18 78.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.796 -0.565 . . . . 0.0 111.067 177.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -55.83 -52.27 64.58 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.568 -0.708 . . . . 0.0 110.569 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.82 75.25 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.389 0.676 . . . . 0.0 110.554 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.8 -55.52 22.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.553 0.741 . . . . 0.0 110.225 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.64 -50.24 70.73 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.856 0.463 . . . . 0.0 110.24 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 tt -55.8 -53.5 55.89 Favored 'General case' 0 N--CA 1.457 -0.099 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -59.91 -36.86 77.88 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 119.49 -0.29 . . . . 0.0 110.941 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -73.83 60.85 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.458 0.572 . . . . 0.0 109.992 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 p -53.79 -37.17 63.21 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.481 1.113 . . . . 0.0 111.175 178.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.45 -22.98 66.82 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.007 0.523 . . . . 0.0 112.076 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.48 31.48 80.37 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 111.511 -0.635 . . . . 0.0 111.511 -173.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -24.16 65.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.73 0.765 . . . . 0.0 111.909 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.4 61.36 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.824 1.202 . . . . 0.0 110.332 -169.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -138.27 144.99 40.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.952 1.701 . . . . 0.0 107.09 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.5 mt -80.82 116.81 25.73 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.062 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -65.98 147.44 53.35 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.11 0.868 . . . . 0.0 110.3 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.76 -46.76 1.3 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.782 0.833 . . . . 0.0 113.213 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.02 -46.41 89.58 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.806 -0.559 . . . . 0.0 111.233 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.51 -38.81 88.72 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.014 -0.429 . . . . 0.0 109.904 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.8 -43.49 98.66 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.843 -0.536 . . . . 0.0 110.389 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -57.02 -48.75 77.75 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.474 -0.766 . . . . 0.0 110.096 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -55.05 -48.03 76.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.731 -0.605 . . . . 0.0 110.551 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.85 70.48 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.873 0.469 . . . . 0.0 110.633 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.3 mtm -61.6 -38.03 86.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.737 -0.602 . . . . 0.0 111.583 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -60.94 -43.41 98.71 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.464 -0.773 . . . . 0.0 111.355 169.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.45 77.09 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.023 0.829 . . . . 0.0 111.331 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.47 -0.62 13.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.088 0.955 . . . . 0.0 112.501 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.66 24.05 68.46 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.406 1.003 . . . . 0.0 112.709 175.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -80.03 165.95 22.03 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.084 0.942 . . . . 0.0 110.525 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -116.19 92.85 37.24 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.737 1.615 . . . . 0.0 107.835 170.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -53.17 140.08 61.63 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.952 3.101 . . . . 0.0 112.98 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -135.95 119.17 16.63 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -40.31 -58.52 1.5 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.289 1.436 . . . . 0.0 114.633 -169.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -51.41 69.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.774 0.43 . . . . 0.0 111.674 -177.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -57.45 -50.69 72.19 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.921 0.488 . . . . 0.0 110.038 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.76 -54.22 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 123.998 0.919 . . . . 0.0 109.786 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -55.44 -50.95 68.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.444 0.697 . . . . 0.0 110.593 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.7 -51.45 67.15 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -177.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.77 -53.29 56.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.222 0.609 . . . . 0.0 110.071 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -50.67 -49.37 25.7 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.783 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -58.64 -44.73 90.16 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.566 1.075 . . . . 0.0 111.471 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -58.67 -47.78 83.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.432 0.293 . . . . 0.0 110.744 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 34.6 mm -71.6 -34.66 53.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 120.716 0.293 . . . . 0.0 110.772 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -81.08 70.45 7.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 109.442 -174.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -62.55 -40.97 98.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.244 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -138.72 -28.92 0.8 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.351 1.061 . . . . 0.0 113.438 -172.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.18 -12.07 22.2 Favored Glycine 0 CA--C 1.539 1.559 0 N-CA-C 115.632 1.013 . . . . 0.0 115.632 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.1 m 48.13 67.23 0.87 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.747 1.619 . . . . 0.0 113.265 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.43 -19.71 50.94 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -113.54 166.46 11.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.6 mm -118.54 116.88 52.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 125.622 1.569 . . . . 0.0 107.142 176.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.16 160.6 32.17 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.561 1.144 . . . . 0.0 110.651 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -48.68 -48.72 39.83 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.368 0.667 . . . . 0.0 111.781 176.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -63.93 -40.65 96.94 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.787 0.721 . . . . 0.0 111.356 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -62.77 -47.46 83.39 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.68 -0.638 . . . . 0.0 109.654 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -59.31 -46.63 88.06 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.415 0.686 . . . . 0.0 110.715 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.16 -48.17 74.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.693 1.197 . . . . 0.0 109.509 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.3 m -56.75 -51.09 70.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.288 0.494 . . . . 0.0 110.432 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.7 ttp -51.8 -52.08 51.69 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 176.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -39.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.092 0.557 . . . . 0.0 111.077 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.8 m -58.46 -46.08 87.3 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.394 0.543 . . . . 0.0 109.849 175.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.86 -52.6 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.239 0.216 . . . . 0.0 111.433 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -81.12 -38.26 27.51 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.234 0.614 . . . . 0.0 112.605 -169.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.7 mtp . . . . . 0 C--O 1.252 1.208 0 CA-C-O 116.388 -1.768 . . . . 0.0 111.1 -169.883 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.5 t -74.93 74.85 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -176.02 -168.24 35.99 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 mt -69.46 107.49 3.37 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 117.25 0.525 . . . . 0.0 110.233 177.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.7 p -64.73 164.96 11.17 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.984 0.421 . . . . 0.0 109.883 171.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -50.81 -47.14 60.06 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.43 -52.38 46.67 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.352 0.661 . . . . 0.0 110.677 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -57.45 -48.52 78.96 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.147 -0.346 . . . . 0.0 110.62 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -58.52 -40.49 83.07 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.602 0.637 . . . . 0.0 111.707 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -58.33 -52.66 64.68 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.51 0.724 . . . . 0.0 109.838 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.43 -45.97 87.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.202 -0.311 . . . . 0.0 111.352 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.47 -46.45 82.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.729 0.812 . . . . 0.0 109.597 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -61.64 -44.95 96.01 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.383 0.538 . . . . 0.0 111.013 177.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -55.88 -55.25 34.86 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.456 0.571 . . . . 0.0 110.114 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.77 -49.46 70.83 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.871 0.468 . . . . 0.0 110.03 178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -51.82 -52.68 47.46 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.887 0.475 . . . . 0.0 110.733 177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.53 -49.17 75.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.755 0.822 . . . . 0.0 110.606 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 tp -53.37 -54.77 31.83 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -61.58 -43.05 99.58 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.456 -0.152 . . . . 0.0 110.909 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.99 62.69 1.15 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.696 1.198 . . . . 0.0 109.547 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 75.0 p -54.24 -33.06 57.56 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.131 0.972 . . . . 0.0 111.169 173.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -63.87 -22.26 66.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.155 0.582 . . . . 0.0 112.249 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.68 28.73 72.03 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.958 0.789 . . . . 0.0 112.132 -177.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.0 p -92.32 9.08 35.51 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.072 0.949 . . . . 0.0 112.64 -173.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.16 16.66 62.6 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.128 0.87 . . . . 0.0 111.545 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.3 p -148.33 121.71 9.05 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.109 1.764 . . . . 0.0 107.536 -169.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.37 110.38 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 169.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.73 148.68 45.97 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.24 -46.24 1.49 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.551 1.14 . . . . 0.0 113.062 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -59.18 -48.03 83.12 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.061 0.457 . . . . 0.0 110.926 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -61.51 -39.69 91.9 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 122.017 -0.427 . . . . 0.0 109.942 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.2 tp -63.56 -42.56 98.34 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.611 -0.681 . . . . 0.0 110.383 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.74 -48.04 80.75 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.687 -0.633 . . . . 0.0 110.168 175.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -54.23 -49.46 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 122.014 -0.429 . . . . 0.0 110.554 173.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.79 -49.08 69.1 Favored 'General case' 0 C--O 1.225 -0.204 0 O-C-N 121.993 -0.442 . . . . 0.0 110.675 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -61.13 -39.88 91.7 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.084 0.554 . . . . 0.0 111.382 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -60.13 -43.35 95.73 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.245 -0.91 . . . . 0.0 111.437 170.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.85 -37.77 77.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.951 0.796 . . . . 0.0 111.346 173.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -72.82 -0.84 14.52 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.042 0.937 . . . . 0.0 112.647 173.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.43 25.67 69.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.318 0.961 . . . . 0.0 112.616 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -82.55 167.06 18.72 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 117.791 0.796 . . . . 0.0 111.035 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -109.35 107.23 59.5 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 169.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -56.87 77.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.638 3.559 . . . . 0.0 114.459 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -65.84 82.5 0.07 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.364 1.066 . . . . 0.0 109.044 170.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -31.29 -55.4 0.24 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 127.817 2.447 . . . . 0.0 114.288 -169.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 mp0 -59.33 -53.27 60.15 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.33 0.586 . . . . 0.0 110.134 -176.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -62.68 -41.66 99.22 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.764 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.99 -52.83 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.095 0.558 . . . . 0.0 109.89 174.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -51.3 70.15 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -53.34 -56.12 19.31 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.483 0.313 . . . . 0.0 110.577 178.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.0 ttp -50.89 -57.92 7.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.303 0.641 . . . . 0.0 110.103 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -51.47 -44.22 32.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 122.724 0.41 . . . . 0.0 110.022 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.2 m -61.75 -49.44 76.41 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.185 0.448 . . . . 0.0 111.558 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -58.09 -45.22 87.53 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.055 0.389 . . . . 0.0 110.848 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.02 -34.21 49.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.241 -0.287 . . . . 0.0 111.101 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -89.46 88.45 7.46 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.65 0.659 . . . . 0.0 110.35 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -19.43 65.99 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.72 0.808 . . . . 0.0 112.246 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -81.8 -44.88 16.36 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.91 -15.75 33.72 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.285 1.422 . . . . 0.0 113.334 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.7 m -78.48 38.82 0.32 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.328 1.564 . . . . 0.0 114.048 -169.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 53.74 39.21 60.91 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.583 1.087 . . . . 0.0 113.059 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.0 p -137.62 124.62 21.43 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.746 1.219 . . . . 0.0 109.602 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.5 mm -91.59 104.34 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.83 151.3 39.37 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -45.41 -47.98 13.64 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.39 -42.35 86.91 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.499 0.591 . . . . 0.0 111.202 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -66.1 -45.38 81.39 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -55.9 -49.94 72.04 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.697 0.399 . . . . 0.0 110.439 174.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -54.28 -49.75 68.89 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 108.902 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.6 m -55.85 -49.68 72.67 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.932 -0.48 . . . . 0.0 111.087 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.7 ttp -54.0 -51.54 63.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.827 -0.545 . . . . 0.0 110.156 177.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 91.4 mmm -62.93 -33.49 75.47 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 122.026 -0.422 . . . . 0.0 111.559 178.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 31.5 m -63.02 -41.7 99.61 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.669 0.668 . . . . 0.0 110.001 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.43 -49.27 69.81 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.123 -0.361 . . . . 0.0 110.676 176.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.22 -49.58 59.76 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 37.9 mtm . . . . . 0 C--O 1.251 1.153 0 C-N-CA 125.053 1.341 . . . . 0.0 110.837 -169.313 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.1 m -52.87 121.65 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 128.72 -38.59 2.02 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -169.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.3 mt -57.82 130.93 48.7 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 169.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -65.3 155.08 36.38 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -53.32 -36.07 60.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.166 -0.334 . . . . 0.0 110.112 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.92 -58.12 9.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.948 0.499 . . . . 0.0 110.307 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -52.67 -47.61 67.05 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.86 -0.525 . . . . 0.0 110.685 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -57.61 -44.57 85.56 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.228 -0.295 . . . . 0.0 110.802 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.07 88.11 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.902 -0.499 . . . . 0.0 110.25 177.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -58.13 -48.89 78.83 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 110.225 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -58.58 -41.27 81.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -61.84 -47.7 83.91 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.728 -0.607 . . . . 0.0 111.237 175.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -56.8 -49.31 75.74 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.73 0.695 . . . . 0.0 110.38 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.05 -50.01 67.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.559 0.344 . . . . 0.0 110.736 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -51.77 -57.5 9.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.343 0.657 . . . . 0.0 110.725 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -57.54 -45.71 84.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 110.69 -177.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 tt -56.24 -53.16 60.51 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.0 -37.34 79.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.746 -0.168 . . . . 0.0 110.907 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -73.66 59.82 0.66 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.174 0.443 . . . . 0.0 110.283 170.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 68.2 p -53.23 -36.42 61.02 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.37 1.068 . . . . 0.0 111.158 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.76 -23.24 67.18 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.382 0.673 . . . . 0.0 112.185 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.56 30.33 77.21 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.733 -0.547 . . . . 0.0 111.733 -174.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -24.39 65.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.839 0.82 . . . . 0.0 111.94 178.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.15 -10.28 65.56 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 124.684 1.135 . . . . 0.0 110.507 -169.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p -141.0 145.5 36.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.313 1.845 . . . . 0.0 106.653 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 95.1 mt -82.87 120.08 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.15 146.26 53.59 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.422 1.01 . . . . 0.0 110.426 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.49 -48.33 0.97 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.895 0.878 . . . . 0.0 113.192 173.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.28 -48.27 81.01 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.939 0.496 . . . . 0.0 111.217 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -60.72 -39.51 88.89 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.766 0.426 . . . . 0.0 110.118 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.02 -40.86 99.03 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.869 -0.52 . . . . 0.0 110.549 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -61.07 -47.28 87.09 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.626 -0.671 . . . . 0.0 110.67 174.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -52.86 -50.47 43.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.446 0.566 . . . . 0.0 110.145 173.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.53 -53.65 48.58 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.16 0.584 . . . . 0.0 110.408 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.8 mtm -56.35 -46.1 80.15 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.387 0.675 . . . . 0.0 111.874 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -54.46 -51.02 66.32 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.437 0.562 . . . . 0.0 110.726 172.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.77 73.8 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.966 -0.459 . . . . 0.0 111.763 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.5 mt -74.99 -0.58 19.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.764 1.226 . . . . 0.0 112.258 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.75 25.05 63.41 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 119.189 0.904 . . . . 0.0 112.878 176.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -76.8 166.19 23.68 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.953 0.876 . . . . 0.0 109.259 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -108.77 109.93 61.19 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -58.48 66.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 124.764 3.643 . . . . 0.0 115.94 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.94 90.16 0.43 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 171.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -31.42 -52.28 0.21 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.97 2.108 . . . . 0.0 113.966 -172.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -62.12 -49.11 77.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.341 0.656 . . . . 0.0 110.639 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.68 -47.45 86.2 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.984 0.913 . . . . 0.0 109.307 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.7 mm -54.7 -53.64 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -57.58 -49.39 76.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.615 0.766 . . . . 0.0 110.387 -179.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -54.81 -56.91 14.29 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.453 0.301 . . . . 0.0 110.257 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.3 ttp -51.74 -56.97 10.66 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.793 0.437 . . . . 0.0 110.355 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.51 -50.6 21.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 123.047 0.539 . . . . 0.0 109.631 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.6 m -58.5 -49.07 78.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.312 0.505 . . . . 0.0 111.447 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -56.78 -44.76 82.17 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.85 0.296 . . . . 0.0 111.079 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.3 mm -71.51 -35.09 55.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 121.997 -0.44 . . . . 0.0 111.118 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -80.12 73.92 6.93 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.563 0.745 . . . . 0.0 110.744 -170.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -66.71 -39.69 88.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.232 0.613 . . . . 0.0 111.727 173.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -130.53 -44.02 1.12 Allowed 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.781 1.232 . . . . 0.0 112.494 -169.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -53.97 -15.62 5.21 Favored Glycine 0 CA--C 1.54 1.643 0 N-CA-C 117.086 1.594 . . . . 0.0 117.086 -169.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 m 47.43 65.3 1.3 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.474 1.51 . . . . 0.0 112.938 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.72 -27.19 20.02 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.6 p -105.95 170.24 8.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -121.46 119.21 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.671 1.588 . . . . 0.0 107.153 177.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.2 157.51 37.6 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.751 0.82 . . . . 0.0 110.479 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -47.14 -50.15 20.91 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 123.515 0.726 . . . . 0.0 112.081 177.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -61.11 -39.81 91.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.41 0.55 . . . . 0.0 111.203 -178.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -66.38 -46.64 75.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.671 0.789 . . . . 0.0 109.75 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -56.4 -46.97 79.91 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.17 0.588 . . . . 0.0 110.331 174.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.68 -45.73 81.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.643 0.777 . . . . 0.0 109.213 176.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.9 m -53.43 -54.24 39.74 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.797 -0.564 . . . . 0.0 110.879 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -53.62 -51.85 61.73 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.081 0.552 . . . . 0.0 110.15 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -56.87 -48.68 77.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.279 0.632 . . . . 0.0 110.06 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.1 m -55.2 -48.37 73.93 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.224 0.61 . . . . 0.0 110.358 177.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.41 97.72 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.556 0.342 . . . . 0.0 111.427 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -65.28 -46.19 81.44 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.338 0.655 . . . . 0.0 110.961 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 67.5 mtm . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.783 -1.58 . . . . 0.0 111.023 179.136 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.3 m -76.35 63.37 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.877 0.871 . . . . 0.0 109.474 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.2 -67.97 1.43 Allowed Glycine 0 CA--C 1.528 0.844 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.84 123.26 19.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 59.9 p -65.44 162.33 18.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.364 0.602 . . . . 0.0 110.262 175.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -55.16 -42.63 73.35 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 169.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.61 -57.45 8.19 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.834 0.854 . . . . 0.0 110.485 173.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -56.0 -49.12 74.51 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.155 -0.34 . . . . 0.0 111.29 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -60.37 -40.88 92.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.173 -179.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -58.37 -52.02 67.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.1 0.409 . . . . 0.0 110.748 172.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -50.78 -49.47 58.2 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.564 0.62 . . . . 0.0 110.595 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.25 -45.08 93.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 122.976 0.51 . . . . 0.0 110.395 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.04 95.8 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 111.885 178.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -44.38 70.82 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 109.951 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.16 -49.38 71.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.898 -0.501 . . . . 0.0 109.854 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -52.42 -51.44 59.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.274 0.63 . . . . 0.0 110.357 175.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -52.87 -53.17 52.89 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.839 0.455 . . . . 0.0 111.211 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -53.88 -53.82 47.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.947 0.499 . . . . 0.0 109.848 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -59.62 -39.19 83.48 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.812 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -73.57 60.61 0.67 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.37 0.532 . . . . 0.0 109.97 171.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.8 p -51.25 -42.22 60.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.945 1.298 . . . . 0.0 111.58 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.17 -21.59 64.89 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.71 35.98 74.61 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -174.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 m -72.11 -15.49 61.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 117.5 0.65 . . . . 0.0 112.374 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.66 -40.13 2.6 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 109.851 -1.3 . . . . 0.0 109.851 -172.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.0 p -116.19 142.25 47.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.395 1.478 . . . . 0.0 109.06 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.0 mt -74.36 124.19 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.078 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -71.53 147.07 48.07 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.009 0.822 . . . . 0.0 110.193 172.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.0 -49.4 0.82 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.158 0.983 . . . . 0.0 113.317 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.46 -46.18 87.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.845 -0.534 . . . . 0.0 111.163 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.54 -39.36 93.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.67 0.388 . . . . 0.0 110.192 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.05 -44.3 96.98 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.757 -0.59 . . . . 0.0 110.016 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.54 -46.84 85.99 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.44 -0.787 . . . . 0.0 110.918 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -52.7 -51.9 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 118.3 0.5 . . . . 0.0 110.113 171.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.03 -53.86 43.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.837 0.455 . . . . 0.0 110.594 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.8 mtm -60.47 -41.45 94.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.153 0.581 . . . . 0.0 111.666 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.65 -48.36 79.67 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.22 -37.95 81.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.16 0.584 . . . . 0.0 111.626 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.0 mt -69.5 -1.31 8.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.202 1.001 . . . . 0.0 111.936 173.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.33 8.26 74.95 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.49 1.043 . . . . 0.0 112.504 174.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -73.79 162.63 28.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.557 1.178 . . . . 0.0 109.1 -177.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -104.73 91.76 4.49 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.35 75.48 2.41 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.14 1.893 . . . . 0.0 112.794 -173.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -64.85 123.08 18.45 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.716 0.806 . . . . 0.0 109.736 171.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -42.16 -59.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.83 1.652 . . . . 0.0 113.298 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mp0 -61.26 -49.87 75.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.365 0.602 . . . . 0.0 109.999 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -57.83 -47.27 83.14 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.159 0.984 . . . . 0.0 109.452 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.6 mm -61.97 -46.67 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 122.804 0.441 . . . . 0.0 110.897 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -56.53 -48.73 76.65 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.561 0.618 . . . . 0.0 110.141 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -57.07 -56.31 23.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.41 0.284 . . . . 0.0 110.421 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -49.67 -57.66 6.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.395 1.478 . . . . 0.0 110.995 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.1 mt -51.67 -50.94 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 123.233 0.613 . . . . 0.0 109.66 177.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.7 m -57.87 -46.19 85.24 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.551 0.614 . . . . 0.0 111.825 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -57.23 -46.25 83.14 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 117.841 0.292 . . . . 0.0 110.931 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.72 -34.66 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 122.336 -0.228 . . . . 0.0 111.285 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -77.01 75.91 3.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.331 0.652 . . . . 0.0 111.014 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -67.84 -48.71 65.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.162 0.585 . . . . 0.0 110.822 173.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -128.43 -27.08 2.69 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.728 1.211 . . . . 0.0 112.689 -169.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.89 -17.22 50.16 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 123.48 0.562 . . . . 0.0 114.496 -171.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.4 m 49.66 62.05 2.84 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.296 1.438 . . . . 0.0 112.174 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.28 -29.76 10.26 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 p -102.85 175.67 5.41 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.4 mm -125.52 118.59 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.938 1.695 . . . . 0.0 106.945 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.5 158.88 34.07 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.963 0.905 . . . . 0.0 110.679 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -48.8 -48.18 41.55 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 123.246 0.618 . . . . 0.0 111.551 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -59.85 -48.32 82.15 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.393 0.542 . . . . 0.0 110.877 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.01 -47.25 83.62 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.923 0.489 . . . . 0.0 109.848 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -58.06 -49.38 77.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.324 0.65 . . . . 0.0 111.223 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.39 -47.33 79.17 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.605 0.762 . . . . 0.0 109.041 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.1 m -57.17 -52.16 66.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.897 0.479 . . . . 0.0 110.397 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -52.64 -53.99 39.43 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.979 0.911 . . . . 0.0 110.222 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.8 tpt -54.59 -54.15 45.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.829 0.852 . . . . 0.0 109.681 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -53.25 -48.43 68.24 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.139 0.576 . . . . 0.0 110.337 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.77 -12.62 11.24 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -60.44 -30.57 69.73 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.407 1.003 . . . . 0.0 111.095 171.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 20.4 ptt? . . . . . 0 C--O 1.25 1.125 0 CA-C-O 116.895 -1.526 . . . . 0.0 110.233 171.351 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.3 m -68.45 140.22 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 172.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 169.15 -158.52 31.08 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 50.8 mt -102.16 104.33 14.92 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.87 0.868 . . . . 0.0 109.633 174.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.0 p -64.8 166.78 8.44 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.304 0.574 . . . . 0.0 109.929 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -52.9 -45.65 67.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 121.768 -0.583 . . . . 0.0 109.947 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.09 -56.84 10.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.681 0.792 . . . . 0.0 110.214 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.55 -44.35 72.8 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 119.563 -0.256 . . . . 0.0 111.056 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -60.79 -39.56 89.35 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.73 0.695 . . . . 0.0 111.834 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -61.81 -49.61 75.64 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.657 0.662 . . . . 0.0 109.42 175.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -53.44 -48.89 68.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.622 0.369 . . . . 0.0 110.459 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -57.49 -44.91 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.937 0.895 . . . . 0.0 110.365 176.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -59.3 -51.65 69.02 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.438 0.563 . . . . 0.0 110.944 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -57.59 -47.38 82.29 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.055 -0.403 . . . . 0.0 110.596 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.94 -52.81 59.44 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.777 0.431 . . . . 0.0 110.306 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.12 -54.84 21.41 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 121.302 0.573 . . . . 0.0 110.469 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.16 -49.77 71.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.984 0.914 . . . . 0.0 110.424 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.03 -53.25 60.23 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.066 0.547 . . . . 0.0 110.502 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -59.5 -34.37 72.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.265 -176.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.04 58.48 0.49 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.516 0.598 . . . . 0.0 110.536 170.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 69.3 p -54.91 -38.3 67.45 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.58 1.152 . . . . 0.0 110.998 178.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -65.43 -19.16 65.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.427 0.691 . . . . 0.0 112.238 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.32 32.23 83.45 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.565 0.62 . . . . 0.0 111.555 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.74 -15.54 60.77 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.932 0.893 . . . . 0.0 112.249 -178.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.57 -39.73 2.84 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -174.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -106.18 145.06 32.0 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.284 1.433 . . . . 0.0 108.561 171.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.3 mt -78.0 121.0 29.84 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.67 146.57 54.64 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.971 0.805 . . . . 0.0 110.427 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.94 -48.93 1.64 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.784 0.834 . . . . 0.0 113.023 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -60.64 -45.14 95.2 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.994 0.518 . . . . 0.0 111.23 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -60.28 -42.45 95.46 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.64 -43.15 99.4 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.566 0.621 . . . . 0.0 110.487 176.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.03 -47.64 84.5 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.553 -0.717 . . . . 0.0 110.864 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.33 -42.42 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 122.895 0.478 . . . . 0.0 110.595 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.84 -54.98 40.77 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.575 -0.703 . . . . 0.0 110.252 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 63.3 mtm -56.46 -47.29 79.5 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.359 0.664 . . . . 0.0 110.736 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -49.81 -55.05 15.63 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.388 0.275 . . . . 0.0 110.591 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.35 81.65 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.615 0.766 . . . . 0.0 111.624 179.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.0 mt -66.66 -6.32 15.07 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 112.053 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.28 15.92 45.74 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 118.983 0.811 . . . . 0.0 112.449 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -76.45 165.94 24.11 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.126 0.963 . . . . 0.0 109.437 172.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -113.57 97.9 45.25 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 105.445 -2.057 . . . . 0.0 105.445 169.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -54.47 88.28 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.837 3.025 . . . . 0.0 115.208 -173.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -66.52 82.38 0.1 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.069 0.948 . . . . 0.0 109.828 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -30.96 -58.49 0.22 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.605 2.362 . . . . 0.0 114.44 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -62.29 -51.33 68.1 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.856 -0.528 . . . . 0.0 110.568 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -59.84 -44.73 93.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.521 0.728 . . . . 0.0 110.145 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -53.2 -54.57 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.911 0.884 . . . . 0.0 109.924 175.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -57.61 -48.37 79.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.825 0.45 . . . . 0.0 110.898 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -55.84 -55.18 35.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.696 0.226 . . . . 0.0 110.499 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 48.7 ttp -53.35 -55.26 26.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.29 0.636 . . . . 0.0 110.238 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.3 mt -49.02 -50.54 14.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 123.219 0.608 . . . . 0.0 109.598 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -58.51 -48.31 81.26 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.47 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.88 -42.35 84.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.767 0.427 . . . . 0.0 111.362 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 51.6 mm -74.07 -34.46 38.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 117.966 0.348 . . . . 0.0 111.031 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -76.5 75.45 3.23 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.472 1.109 . . . . 0.0 110.029 -177.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -56.23 -21.92 26.4 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -172.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -109.59 6.18 23.69 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.19 0.905 . . . . 0.0 111.349 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.08 40.95 44.94 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.866 1.222 . . . . 0.0 113.264 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.0 p -78.43 -14.92 59.16 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 112.779 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.77 9.63 77.63 Favored Glycine 0 CA--C 1.534 1.259 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -168.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.7 p -138.74 159.23 42.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.66 0.784 . . . . 0.0 110.396 -173.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.9 mm -111.49 120.38 61.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.358 1.463 . . . . 0.0 108.299 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.37 153.94 35.34 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.31 0.644 . . . . 0.0 110.397 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -50.66 -43.37 57.28 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.346 0.658 . . . . 0.0 112.34 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.9 -45.61 93.93 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.472 0.578 . . . . 0.0 110.759 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -62.14 -46.85 87.15 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -56.41 -50.42 71.67 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.774 0.83 . . . . 0.0 110.877 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.3 tp -57.62 -44.64 85.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.44 0.696 . . . . 0.0 109.995 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.4 m -58.54 -50.07 75.11 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.951 -0.468 . . . . 0.0 110.378 176.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -54.98 -47.0 75.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.838 0.855 . . . . 0.0 110.521 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -56.21 -55.95 26.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.135 -0.353 . . . . 0.0 110.521 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -52.92 -39.21 62.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.071 0.948 . . . . 0.0 111.504 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.41 -37.96 73.57 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.457 0.303 . . . . 0.0 111.589 177.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -81.58 -49.86 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.102 0.41 . . . . 0.0 110.544 177.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . 0.273 3.6 ppp? . . . . . 0 C--O 1.251 1.136 0 C-N-CA 127.438 2.295 . . . . 0.0 114.066 -171.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 120.957 0.408 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 12.8 p -68.93 179.0 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 169.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -42.68 -34.38 1.79 Allowed Glycine 0 CA--C 1.532 1.15 0 C-N-CA 124.911 1.243 . . . . 0.0 113.471 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 39.4 mt -83.96 100.83 11.28 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.907 0.883 . . . . 0.0 110.169 169.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.2 p -64.74 168.87 5.61 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -52.18 -45.76 65.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.884 -0.51 . . . . 0.0 110.58 172.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -53.29 -55.69 22.58 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.711 0.805 . . . . 0.0 110.389 176.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -55.05 -44.31 74.59 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.488 -0.292 . . . . 0.0 110.563 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -60.0 -39.25 85.12 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.818 0.735 . . . . 0.0 111.659 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -62.16 -50.27 72.51 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.188 0.903 . . . . 0.0 109.721 176.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -53.48 -49.61 67.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.033 0.445 . . . . 0.0 110.172 177.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.3 mt -60.89 -41.34 88.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.49 1.116 . . . . 0.0 110.435 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.11 -47.14 85.91 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.878 0.763 . . . . 0.0 110.683 175.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -55.95 -54.68 41.82 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.73 -49.23 68.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.165 0.586 . . . . 0.0 110.446 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -52.22 -56.08 17.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.894 0.878 . . . . 0.0 110.702 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -54.5 -49.97 68.92 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 110.583 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -56.39 -53.85 52.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.198 0.199 . . . . 0.0 110.607 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -60.19 -35.17 74.77 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.454 0.302 . . . . 0.0 111.065 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -72.35 58.47 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.218 0.607 . . . . 0.0 110.421 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.2 p -55.41 -36.95 67.0 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 110.967 177.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -65.64 -17.65 64.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.379 0.672 . . . . 0.0 112.401 177.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.93 31.14 79.95 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.773 0.715 . . . . 0.0 111.984 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.81 5.45 25.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.89 1.276 . . . . 0.0 112.844 -179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.4 12.08 37.38 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.499 1.523 . . . . 0.0 111.915 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 42.5 p -156.63 135.32 11.64 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 104.751 -2.315 . . . . 0.0 104.751 -169.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.1 mt -85.07 116.25 28.23 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -63.88 144.24 57.22 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.82 0.737 . . . . 0.0 109.767 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.21 -46.31 1.48 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 174.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -54.99 -52.65 62.43 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.385 0.674 . . . . 0.0 111.019 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -58.19 -38.92 77.66 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.026 0.531 . . . . 0.0 109.912 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.2 tp -65.37 -45.69 83.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.512 0.596 . . . . 0.0 111.551 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.282 20.3 pttp -62.28 -39.4 92.81 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.88 -1.137 . . . . 0.0 111.673 175.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.8 -50.35 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.346 0.521 . . . . 0.0 110.151 171.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -53.03 57.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.875 0.87 . . . . 0.0 110.309 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtm -57.28 -42.21 81.21 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.736 0.414 . . . . 0.0 111.421 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -56.15 18.01 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 172.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.79 -39.12 73.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.197 0.599 . . . . 0.0 112.003 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.1 mt -70.64 -6.79 39.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.53 1.132 . . . . 0.0 112.539 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.4 22.61 36.81 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.456 1.025 . . . . 0.0 112.774 175.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -76.19 -179.2 4.88 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.211 1.005 . . . . 0.0 109.916 174.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.36 102.87 36.04 Favored Pre-proline 0 N--CA 1.452 -0.359 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 169.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -59.96 69.8 0.07 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.021 3.147 . . . . 0.0 115.699 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.49 88.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -32.15 -49.33 0.19 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.0 2.12 . . . . 0.0 115.074 -173.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -60.98 -48.27 82.6 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.571 0.623 . . . . 0.0 111.144 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -68.53 -42.43 78.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.457 0.703 . . . . 0.0 109.577 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mm -52.72 -57.69 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.329 0.651 . . . . 0.0 109.336 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -54.68 -51.05 66.74 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.805 0.842 . . . . 0.0 110.475 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -54.16 -57.92 9.33 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.197 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.3 ttp -56.92 -53.04 62.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.494 0.317 . . . . 0.0 110.254 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.4 mt -50.19 -49.79 21.84 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.299 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.2 m -58.3 -48.39 80.64 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.372 0.533 . . . . 0.0 111.482 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -57.72 -45.07 86.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.424 0.29 . . . . 0.0 111.401 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.4 mm -71.69 -33.62 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 122.206 -0.308 . . . . 0.0 110.832 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -75.81 69.84 2.51 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.03 0.932 . . . . 0.0 110.163 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.95 -41.89 92.88 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.586 1.154 . . . . 0.0 110.875 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -142.48 -27.49 0.61 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.306 1.042 . . . . 0.0 113.658 -169.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.1 -13.2 26.48 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 -172.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m 50.13 65.73 1.35 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.488 1.515 . . . . 0.0 112.849 169.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.96 -25.13 26.76 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -178.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.5 p -106.63 167.71 9.67 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.9 mm -121.04 113.7 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.775 1.63 . . . . 0.0 106.804 173.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -71.56 159.32 34.66 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.402 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -50.94 -43.86 60.25 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.259 0.624 . . . . 0.0 112.03 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.91 -48.52 81.35 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.387 0.54 . . . . 0.0 110.722 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -60.11 -47.44 85.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.852 0.461 . . . . 0.0 109.931 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -56.88 -50.37 72.69 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.755 0.822 . . . . 0.0 110.456 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.64 -44.17 89.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.389 0.676 . . . . 0.0 109.88 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.0 m -56.97 -49.61 75.19 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.907 -0.496 . . . . 0.0 110.221 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 61.2 ttp -52.67 -50.94 62.25 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.9 mmt -59.5 -42.24 91.73 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.6 m -59.55 -47.66 84.67 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.428 0.691 . . . . 0.0 109.989 177.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.64 -44.99 93.3 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.746 0.418 . . . . 0.0 110.97 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -66.21 -45.11 81.9 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.273 0.229 . . . . 0.0 111.289 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 35.3 ttp . . . . . 0 C--O 1.25 1.126 0 C-N-CA 125.971 1.708 . . . . 0.0 109.252 -169.79 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.0 mtt85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 110.783 -0.08 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.39 59.61 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.665 0.786 . . . . 0.0 109.614 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.61 -61.76 1.97 Allowed Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.279 -1.529 . . . . 0.0 109.279 -169.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.87 114.02 3.4 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.908 0.883 . . . . 0.0 110.356 174.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.9 p -70.07 170.17 11.98 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -55.77 -36.75 67.69 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.745 -0.597 . . . . 0.0 110.519 169.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -68.95 -46.36 68.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.668 -0.645 . . . . 0.0 109.562 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.39 -43.06 88.37 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.457 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.37 -45.78 92.29 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.921 0.782 . . . . 0.0 111.166 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -54.36 -54.3 42.35 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.15 0.432 . . . . 0.0 110.232 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -54.25 -46.78 72.69 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.257 0.623 . . . . 0.0 111.054 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.0 mt -59.59 -45.97 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.307 0.643 . . . . 0.0 110.3 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -60.15 -45.94 91.37 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.653 -0.655 . . . . 0.0 110.879 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -57.19 -51.72 68.2 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.072 0.549 . . . . 0.0 110.323 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -49.39 72.03 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.84 0.456 . . . . 0.0 110.691 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -52.79 -57.17 11.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.48 0.712 . . . . 0.0 110.263 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -52.46 -50.56 62.41 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.241 1.016 . . . . 0.0 110.836 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.23 -54.71 43.73 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -59.86 -33.58 71.99 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.424 -0.172 . . . . 0.0 111.044 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -72.51 51.55 0.26 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.449 1.099 . . . . 0.0 110.796 172.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 66.4 p -52.85 -37.09 59.81 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.934 1.294 . . . . 0.0 111.618 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.33 -22.04 66.82 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.558 0.743 . . . . 0.0 112.639 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.79 22.8 73.98 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 121.723 -0.611 . . . . 0.0 111.761 -175.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.1 p -75.11 -10.86 59.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.713 1.605 . . . . 0.0 112.616 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.6 14.62 50.85 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.24 0.924 . . . . 0.0 111.854 -173.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.7 p -155.48 120.55 4.84 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -173.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -78.95 122.19 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.67 145.32 48.97 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 174.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.99 -48.24 0.76 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.615 1.166 . . . . 0.0 113.052 172.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.75 -48.62 80.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.021 0.528 . . . . 0.0 111.111 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -59.99 -42.47 94.29 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.027 -0.421 . . . . 0.0 109.888 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -62.64 -40.86 98.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.947 -0.471 . . . . 0.0 110.534 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -60.23 -47.76 84.59 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.6 t -54.55 -48.97 69.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 CA-C-N 118.216 0.462 . . . . 0.0 110.2 173.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.75 -51.17 64.23 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.163 -0.336 . . . . 0.0 110.592 176.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.9 mtm -59.21 -42.09 90.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.377 0.671 . . . . 0.0 111.948 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -57.69 -49.41 76.6 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.516 0.598 . . . . 0.0 110.018 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.95 -39.15 77.39 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.947 -0.471 . . . . 0.0 111.63 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -72.37 -1.88 17.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.528 1.131 . . . . 0.0 112.337 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 27.12 72.11 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-N 119.054 0.843 . . . . 0.0 112.373 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -80.78 164.07 23.01 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -106.05 92.51 6.62 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 107.634 -1.246 . . . . 0.0 107.634 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -75.8 75.84 3.91 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.115 1.876 . . . . 0.0 112.227 -169.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.14 98.68 0.11 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.692 1.197 . . . . 0.0 110.128 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -31.71 -57.09 0.28 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.314 2.245 . . . . 0.0 113.867 -174.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -51.71 -49.88 61.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.234 0.614 . . . . 0.0 111.176 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -70.5 -41.75 72.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 mm -57.0 -46.77 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.141 0.576 . . . . 0.0 110.995 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -55.52 -51.54 66.66 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.297 0.499 . . . . 0.0 110.421 177.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -59.37 -51.42 69.98 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.291 -0.255 . . . . 0.0 110.695 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.8 ttp -50.0 -56.79 9.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.535 0.734 . . . . 0.0 109.974 177.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -50.65 -49.72 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 C-N-CA 123.526 0.73 . . . . 0.0 109.563 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 p -58.56 -47.02 85.63 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.479 0.581 . . . . 0.0 111.219 -178.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -60.56 -43.42 97.28 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.642 0.777 . . . . 0.0 110.903 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.5 mm -71.53 -34.15 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 O-C-N 122.218 -0.301 . . . . 0.0 110.766 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -78.47 67.31 4.22 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.586 -0.696 . . . . 0.0 110.559 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -47.35 -33.09 5.43 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.921 1.688 . . . . 0.0 113.028 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -97.86 9.44 42.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.849 1.26 . . . . 0.0 109.923 -173.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 35.85 40.74 0.36 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 127.428 2.442 . . . . 0.0 114.173 -175.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -89.29 19.38 4.41 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.222 0.609 . . . . 0.0 112.366 -170.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 55.97 18.52 19.21 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.756 1.17 . . . . 0.0 112.973 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.4 p -161.32 161.56 30.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -170.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.8 mm -99.88 110.09 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.18 158.07 36.47 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.578 0.751 . . . . 0.0 110.299 170.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.46 -47.74 38.1 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.707 0.803 . . . . 0.0 112.24 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.51 -40.73 95.65 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.356 0.525 . . . . 0.0 110.733 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -65.6 -45.93 81.29 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.32 -47.31 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.65 0.78 . . . . 0.0 111.1 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.1 tp -57.15 -49.02 77.26 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.527 0.731 . . . . 0.0 109.699 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 m -55.67 -48.76 74.5 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.573 0.349 . . . . 0.0 110.257 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 28.0 ttt -52.95 -54.1 39.95 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.868 0.867 . . . . 0.0 110.23 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.1 mmt -54.96 -49.67 70.81 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.056 -0.403 . . . . 0.0 111.087 176.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.8 m -56.96 -37.24 71.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.288 0.635 . . . . 0.0 110.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.33 -44.37 65.23 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.897 -0.502 . . . . 0.0 111.278 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -63.82 -46.86 83.17 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 122.729 0.411 . . . . 0.0 112.007 -177.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.8 ptm . . . . . 0 C--O 1.252 1.199 0 CA-C-O 116.792 -1.575 . . . . 0.0 112.328 -171.984 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 120.715 0.293 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 43.4 t -72.55 86.72 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 121.322 0.582 . . . . 0.0 109.803 -169.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.76 -63.43 3.77 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.3 mt -72.35 85.66 1.1 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 169.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.0 p -63.87 168.93 4.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.89 0.876 . . . . 0.0 109.48 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -59.46 -39.64 84.29 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 173.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -52.99 -55.22 25.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.765 1.226 . . . . 0.0 110.69 169.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -56.53 -49.13 75.68 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.447 -0.783 . . . . 0.0 110.702 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -59.11 -40.08 84.24 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.263 0.483 . . . . 0.0 111.616 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.78 -55.83 27.72 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.561 0.619 . . . . 0.0 110.6 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -53.76 -48.58 69.59 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.735 0.302 . . . . 0.0 110.847 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 86.1 mt -58.96 -47.54 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 123.915 0.886 . . . . 0.0 110.334 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -58.88 -51.78 68.55 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.145 0.578 . . . . 0.0 110.59 177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -56.19 -51.54 67.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.054 0.542 . . . . 0.0 110.304 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.33 -51.03 69.75 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 110.814 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -50.18 -58.65 5.13 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.987 0.915 . . . . 0.0 109.706 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -52.81 -51.35 61.17 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.812 0.845 . . . . 0.0 110.252 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tt -56.18 -52.81 63.04 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.114 0.166 . . . . 0.0 111.055 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -60.17 -40.65 90.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.814 0.34 . . . . 0.0 110.706 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -77.28 40.21 0.27 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.651 1.18 . . . . 0.0 112.552 -171.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.4 p -43.93 -67.3 0.29 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.761 1.624 . . . . 0.0 111.653 -174.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -92.13 -25.23 18.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.092 -171.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -70.32 -39.4 70.77 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 177.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m 41.6 58.82 2.63 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.342 1.457 . . . . 0.0 112.594 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.87 -53.07 0.44 Allowed Glycine 0 CA--C 1.523 0.59 0 N-CA-C 108.71 -1.756 . . . . 0.0 108.71 -175.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.1 p -137.74 130.89 30.48 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.319 0.648 . . . . 0.0 109.684 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.9 mt -73.76 112.2 10.04 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.42 146.83 50.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.057 0.39 . . . . 0.0 110.037 172.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.91 -48.0 0.73 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.043 0.937 . . . . 0.0 113.067 172.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -58.78 -46.75 86.82 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.176 0.59 . . . . 0.0 111.441 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.94 -39.76 93.21 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.862 -0.523 . . . . 0.0 109.644 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.51 -43.21 99.37 Favored 'General case' 0 CA--C 1.532 0.262 0 O-C-N 121.82 -0.55 . . . . 0.0 110.518 174.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -58.2 -48.19 81.11 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.459 -0.775 . . . . 0.0 110.478 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.35 -48.47 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 122.183 -0.323 . . . . 0.0 110.294 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -50.39 66.62 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.678 0.391 . . . . 0.0 110.635 177.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.4 mtm -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.437 0.695 . . . . 0.0 111.359 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -57.37 -46.74 83.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.893 0.77 . . . . 0.0 111.087 171.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.41 -38.23 76.98 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.754 -0.591 . . . . 0.0 111.479 175.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.2 mt -73.16 0.01 12.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.471 1.108 . . . . 0.0 112.456 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.3 71.95 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.184 0.897 . . . . 0.0 113.021 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -76.78 160.37 29.35 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.042 0.921 . . . . 0.0 109.755 177.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -107.18 108.31 61.71 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 169.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -56.3 76.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.445 3.43 . . . . 0.0 115.201 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.7 mmmm -65.7 80.38 0.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.958 1.303 . . . . 0.0 108.855 169.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -31.86 -52.51 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.208 2.203 . . . . 0.0 115.07 -170.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -63.33 -45.37 91.59 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.519 -0.738 . . . . 0.0 111.379 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.76 -43.57 88.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.7 mm -55.76 -48.29 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.055 0.542 . . . . 0.0 109.897 174.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -49.79 76.46 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.799 -0.563 . . . . 0.0 110.87 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -54.91 -56.04 23.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.802 0.273 . . . . 0.0 110.532 177.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.6 ttt -47.7 -62.46 1.44 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.183 1.393 . . . . 0.0 110.187 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.72 -49.05 26.95 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 123.088 0.555 . . . . 0.0 109.62 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -58.61 -49.85 75.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.552 0.615 . . . . 0.0 111.601 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -56.81 -44.65 82.2 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.864 0.466 . . . . 0.0 111.042 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 mm -71.85 -34.58 51.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 O-C-N 122.325 -0.234 . . . . 0.0 111.011 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -76.86 73.24 3.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.776 0.83 . . . . 0.0 110.263 -175.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -56.39 -45.71 80.46 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.522 0.729 . . . . 0.0 111.136 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -145.71 -27.04 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.331 1.052 . . . . 0.0 113.107 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.05 -11.75 6.48 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 115.925 1.13 . . . . 0.0 115.925 -173.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.2 m 49.67 70.01 0.54 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.706 1.602 . . . . 0.0 113.175 169.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.09 -23.21 25.24 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -108.66 159.98 16.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.0 mm -116.99 108.79 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 126.193 1.797 . . . . 0.0 106.742 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -69.09 155.99 39.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.778 0.831 . . . . 0.0 110.139 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -46.33 -47.01 18.55 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.184 0.594 . . . . 0.0 112.155 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -58.48 -43.84 89.14 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.674 0.67 . . . . 0.0 110.779 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.12 -43.14 92.95 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -58.41 -49.0 78.83 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.406 0.622 . . . . 0.0 110.495 176.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.17 -42.47 86.08 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.305 0.642 . . . . 0.0 110.027 175.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 m -56.89 -47.5 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.525 0.602 . . . . 0.0 110.288 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.1 tmm? -55.38 -48.21 74.65 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.101 -0.374 . . . . 0.0 110.664 175.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.3 mmt -57.36 -47.47 81.53 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 122.119 -0.363 . . . . 0.0 110.322 177.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.5 m -57.32 -46.33 83.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.783 0.833 . . . . 0.0 110.269 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.83 -43.08 99.56 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.917 0.487 . . . . 0.0 111.012 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -66.24 -45.56 80.18 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.459 0.303 . . . . 0.0 111.178 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 tpp . . . . . 0 C--O 1.251 1.165 0 CA-C-O 116.946 -1.502 . . . . 0.0 111.095 -175.126 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 m -47.86 118.55 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.305 0.642 . . . . 0.0 109.838 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 128.73 -44.6 1.21 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -169.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 48.6 mt -76.07 86.04 2.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.985 0.514 . . . . 0.0 109.805 177.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 51.7 p -64.69 161.78 17.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.583 0.753 . . . . 0.0 110.575 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -48.59 -41.2 30.03 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.351 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -53.01 -53.6 47.67 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.939 0.896 . . . . 0.0 110.14 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.55 -40.23 93.94 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.52 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -55.41 -46.24 76.63 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.522 0.601 . . . . 0.0 110.561 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -58.63 -50.79 72.55 Favored 'General case' 0 C--O 1.225 -0.19 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -53.76 -48.31 69.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.524 0.33 . . . . 0.0 111.243 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.13 -46.54 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.171 0.588 . . . . 0.0 109.676 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -61.34 -44.59 96.93 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.895 -0.503 . . . . 0.0 111.417 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -56.78 -50.46 72.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.706 -0.621 . . . . 0.0 110.006 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.31 69.16 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.466 0.306 . . . . 0.0 110.575 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -51.28 -57.66 8.26 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.453 0.701 . . . . 0.0 111.078 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -56.74 -46.95 81.05 Favored 'General case' 0 C--O 1.227 -0.095 0 C-N-CA 123.142 0.577 . . . . 0.0 110.674 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.1 tt -56.1 -52.81 62.98 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.497 0.319 . . . . 0.0 110.248 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -60.06 -40.43 89.46 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -72.56 59.97 0.46 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.709 0.404 . . . . 0.0 110.808 170.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.8 p -51.81 -37.99 53.92 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.774 1.23 . . . . 0.0 111.275 176.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -65.98 -22.62 66.48 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.248 0.619 . . . . 0.0 112.241 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.9 34.42 77.09 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -67.55 -20.18 65.38 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.824 0.812 . . . . 0.0 112.09 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.48 1.19 75.03 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.045 1.307 . . . . 0.0 110.375 -169.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 79.0 p -151.77 149.52 29.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.366 2.266 . . . . 0.0 106.498 -171.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.7 mt -86.71 115.76 28.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.95 145.9 55.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.269 0.94 . . . . 0.0 110.651 174.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.6 -50.04 1.13 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.927 0.891 . . . . 0.0 113.069 173.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -54.36 -53.68 50.64 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.693 0.797 . . . . 0.0 110.655 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -58.71 -37.56 76.41 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.628 0.771 . . . . 0.0 110.412 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.1 tp -67.07 -46.61 73.78 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.885 -0.509 . . . . 0.0 110.876 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.283 21.1 pttp -63.65 -36.03 82.5 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.487 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.4 t -57.38 -48.57 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 118.286 0.494 . . . . 0.0 110.502 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.85 -50.66 65.74 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.834 -0.541 . . . . 0.0 110.003 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 19.0 mtm -57.12 -45.77 83.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.68 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -54.19 -50.56 66.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.863 0.756 . . . . 0.0 110.48 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.92 -40.25 75.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.123 -0.361 . . . . 0.0 111.219 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.5 mt -74.25 1.76 10.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.264 1.026 . . . . 0.0 112.798 175.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.95 20.17 65.9 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.181 0.901 . . . . 0.0 113.292 174.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -77.77 163.1 26.43 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.149 0.974 . . . . 0.0 109.506 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -109.02 108.18 60.44 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.79 76.11 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.597 3.531 . . . . 0.0 115.669 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.41 84.01 0.16 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -31.48 -57.87 0.26 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 127.426 2.291 . . . . 0.0 114.067 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.71 -44.74 81.87 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.675 -0.641 . . . . 0.0 111.634 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -71.0 -39.02 72.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.8 mm -54.02 -49.15 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 171.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -58.81 -49.75 76.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.963 -0.541 . . . . 0.0 111.386 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -52.32 -58.16 7.52 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.529 0.604 . . . . 0.0 110.103 177.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.7 ttt -49.03 -60.93 2.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.921 1.288 . . . . 0.0 110.16 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.7 mt -50.48 -49.05 25.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 122.967 0.507 . . . . 0.0 109.71 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.5 m -58.83 -49.27 78.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.333 0.515 . . . . 0.0 111.581 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.04 -45.04 83.48 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.715 0.234 . . . . 0.0 111.203 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.1 mm -72.0 -34.33 50.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 O-C-N 122.034 -0.416 . . . . 0.0 111.02 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -78.42 74.01 4.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.886 0.874 . . . . 0.0 110.404 -174.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.44 -47.31 86.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.061 0.545 . . . . 0.0 111.133 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -134.75 -32.63 0.98 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.484 1.114 . . . . 0.0 112.861 -169.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.82 -8.4 4.23 Favored Glycine 0 CA--C 1.54 1.633 0 N-CA-C 116.421 1.329 . . . . 0.0 116.421 -171.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m 44.88 69.69 0.41 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.051 1.741 . . . . 0.0 113.674 169.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.32 -21.93 41.56 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -112.04 161.42 16.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.8 mm -104.82 123.13 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 124.914 1.285 . . . . 0.0 107.65 173.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -74.79 161.15 29.86 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.756 0.823 . . . . 0.0 110.105 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.08 -46.81 84.83 Favored 'General case' 0 C--O 1.226 -0.155 0 O-C-N 121.955 -0.466 . . . . 0.0 111.573 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -57.91 -46.62 84.69 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.946 0.339 . . . . 0.0 110.951 178.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -58.73 -51.4 70.1 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.073 0.549 . . . . 0.0 109.985 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -54.74 -51.95 64.05 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.51 0.724 . . . . 0.0 110.822 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.58 -48.71 71.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.241 0.617 . . . . 0.0 109.908 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.3 m -56.61 -49.55 74.62 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.403 0.281 . . . . 0.0 110.532 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.6 ttp -54.82 -53.25 57.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.771 0.829 . . . . 0.0 110.62 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 92.5 mmm -58.85 -45.53 89.87 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.137 0.575 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.3 m -58.98 -44.19 91.52 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.879 0.472 . . . . 0.0 110.624 178.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.14 -58.96 5.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -83.14 48.77 1.42 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.192 0.597 . . . . 0.0 110.965 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 15.2 ptp . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.647 -1.168 . . . . 0.0 110.776 176.663 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 61.0 ttm-85 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.537 0.208 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.0 p -156.87 157.11 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 159.43 -58.27 0.33 Allowed Glycine 0 CA--C 1.523 0.563 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 93.5 mt -129.22 85.0 2.27 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.456 1.502 . . . . 0.0 108.503 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 64.7 p -65.6 159.89 23.73 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.034 0.445 . . . . 0.0 110.35 174.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -54.1 -36.84 63.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.106 0.479 . . . . 0.0 110.286 171.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -61.94 -51.45 68.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.528 -0.732 . . . . 0.0 109.682 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -53.47 -47.3 69.91 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.143 0.428 . . . . 0.0 110.712 174.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -55.79 -48.06 76.02 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.554 0.616 . . . . 0.0 111.243 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -56.15 -51.25 68.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.778 0.431 . . . . 0.0 110.883 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -55.13 -51.14 67.38 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.261 0.624 . . . . 0.0 110.8 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.5 mt -58.76 -46.58 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.16 0.584 . . . . 0.0 109.725 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -59.39 -47.39 85.65 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.895 -0.503 . . . . 0.0 110.852 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.33 -53.17 60.52 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.086 0.554 . . . . 0.0 110.271 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.68 -48.94 71.79 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.646 0.378 . . . . 0.0 110.587 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -52.7 -57.62 9.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.936 0.895 . . . . 0.0 110.787 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -56.56 -47.88 78.53 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.413 0.685 . . . . 0.0 110.449 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.35 -53.21 59.05 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.76 0.254 . . . . 0.0 110.365 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -60.82 -38.47 85.52 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.987 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.75 61.9 0.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.62 0.645 . . . . 0.0 109.684 170.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.7 p -52.67 -38.58 60.72 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.768 1.227 . . . . 0.0 111.369 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -66.48 -22.43 66.19 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.31 34.84 81.18 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.326 -0.71 . . . . 0.0 111.326 -175.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 m -67.07 -25.38 66.21 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.593 0.697 . . . . 0.0 111.912 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.6 -20.59 36.57 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.034 1.302 . . . . 0.0 110.547 -169.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.6 p -137.78 147.98 45.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.591 1.956 . . . . 0.0 107.562 -177.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -80.33 122.89 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.81 145.53 52.06 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.061 0.846 . . . . 0.0 110.086 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.18 -46.4 2.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.924 0.89 . . . . 0.0 113.146 175.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -60.72 -46.27 91.07 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.927 -0.483 . . . . 0.0 111.047 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -60.31 -38.9 85.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.8 tp -62.75 -43.4 98.91 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.814 -0.554 . . . . 0.0 110.257 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.2 -47.84 82.19 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.563 -0.711 . . . . 0.0 110.34 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.1 t -55.23 -49.23 74.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 122.246 -0.284 . . . . 0.0 110.325 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.59 -48.9 68.8 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.974 0.509 . . . . 0.0 110.695 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mtm -62.26 -41.4 98.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.295 0.638 . . . . 0.0 111.426 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -57.44 -46.08 83.98 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.807 0.731 . . . . 0.0 110.802 170.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.95 -38.44 79.06 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.597 0.635 . . . . 0.0 111.531 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.0 mt -71.6 -0.44 10.71 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.198 0.999 . . . . 0.0 112.378 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.8 18.87 74.36 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.231 0.92 . . . . 0.0 112.66 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -78.38 160.21 27.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.109 0.954 . . . . 0.0 109.623 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -108.21 107.26 60.02 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -54.95 75.26 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.991 3.794 . . . . 0.0 116.028 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -65.07 85.04 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.495 1.118 . . . . 0.0 108.522 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -31.43 -58.16 0.25 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 127.234 2.214 . . . . 0.0 113.878 -171.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -57.56 -46.15 84.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.707 -0.621 . . . . 0.0 112.12 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -66.08 -43.22 87.97 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.7 mm -54.06 -53.57 27.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 C-N-CA 123.224 0.61 . . . . 0.0 109.796 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -56.34 -52.04 66.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.188 0.595 . . . . 0.0 110.825 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.02 -58.08 8.66 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.64 -54.21 40.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.149 0.98 . . . . 0.0 110.534 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.9 mt -51.08 -50.82 23.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.46 -46.96 85.53 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.482 0.583 . . . . 0.0 111.712 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -57.68 -45.37 85.69 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.855 0.462 . . . . 0.0 110.995 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.24 -34.86 55.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.633 0.254 . . . . 0.0 110.608 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -78.87 76.6 5.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.78 0.832 . . . . 0.0 110.275 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -74.74 -51.66 13.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.12 0.568 . . . . 0.0 110.313 172.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -116.94 -25.9 7.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.789 1.636 . . . . 0.0 112.041 -173.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.84 -20.36 47.77 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.129 0.871 . . . . 0.0 115.056 -169.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m 50.36 58.76 5.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.028 1.331 . . . . 0.0 111.989 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.03 -27.95 16.05 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.633 -0.537 . . . . 0.0 111.951 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.8 p -102.69 175.21 5.57 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 170.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.0 mm -116.09 120.43 64.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 172.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.96 158.41 35.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.478 1.111 . . . . 0.0 110.542 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -48.99 -52.97 21.92 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.075 0.55 . . . . 0.0 111.77 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.8 -38.76 92.28 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 119.006 0.821 . . . . 0.0 111.252 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.5 -49.07 79.03 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.926 -0.483 . . . . 0.0 109.781 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.23 -45.73 83.62 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.578 0.751 . . . . 0.0 110.994 175.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.61 -50.37 68.23 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.773 1.229 . . . . 0.0 108.903 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.7 m -58.4 -48.74 79.68 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.068 0.547 . . . . 0.0 110.404 178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.29 -51.37 64.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.727 0.811 . . . . 0.0 110.187 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.1 mmt -55.68 -53.53 55.42 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 122.288 -0.257 . . . . 0.0 110.68 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 m -51.7 -44.93 63.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.226 0.61 . . . . 0.0 110.692 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.95 -27.7 61.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -79.68 -14.62 58.64 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.87 0.759 . . . . 0.0 112.293 177.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 58.7 mtt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 116.977 -1.487 . . . . 0.0 110.712 -178.041 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.614 0.245 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.9 m -79.63 82.69 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 169.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 58.64 -149.84 36.0 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.16 76.78 2.99 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.355 1.074 . . . . 0.0 109.577 170.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.4 m -63.56 157.67 23.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.531 169.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -43.95 -49.24 8.57 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 123.877 0.871 . . . . 0.0 111.669 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -49.62 -49.77 45.61 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.269 0.628 . . . . 0.0 111.827 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -64.63 -42.89 95.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.76 -0.587 . . . . 0.0 109.981 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -59.91 -39.34 85.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.471 0.578 . . . . 0.0 111.557 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -59.47 -53.94 52.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.508 0.723 . . . . 0.0 109.711 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -53.89 -49.08 69.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 83.6 mt -57.57 -43.51 83.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.125 0.97 . . . . 0.0 109.965 177.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -63.25 -44.56 94.83 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.539 -0.725 . . . . 0.0 111.341 177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -56.67 -50.58 71.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.309 0.504 . . . . 0.0 110.145 175.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.12 -52.26 63.83 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 110.372 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.98 -54.13 16.94 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.879 0.872 . . . . 0.0 110.641 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.5 -51.53 66.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.472 0.709 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -52.8 -53.53 47.05 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.89 -38.16 81.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.887 0.475 . . . . 0.0 111.31 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -73.12 62.48 0.65 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.128 0.422 . . . . 0.0 110.268 174.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 p -57.34 -36.14 70.8 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.973 0.909 . . . . 0.0 111.139 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -66.14 -21.98 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.179 0.592 . . . . 0.0 111.919 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.12 35.09 91.0 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -25.47 62.64 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.772 0.829 . . . . 0.0 111.394 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.83 -24.75 30.85 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.3 p -130.45 138.22 50.19 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.723 1.609 . . . . 0.0 107.546 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.0 mt -79.81 110.92 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.104 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -175.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -60.75 147.22 43.16 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.194 -0.316 . . . . 0.0 110.2 173.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.96 -48.07 1.54 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -59.42 -45.21 92.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.958 0.503 . . . . 0.0 111.29 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -62.22 -38.41 89.08 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.002 -0.436 . . . . 0.0 109.852 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.36 -40.09 93.14 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.653 -0.654 . . . . 0.0 110.91 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -58.45 -47.28 84.52 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.321 -0.862 . . . . 0.0 110.738 171.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.1 t -53.99 -49.11 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 118.433 0.561 . . . . 0.0 109.908 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.66 -56.0 18.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.023 0.529 . . . . 0.0 110.82 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 18.0 mtm -53.45 -49.59 67.07 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.042 0.537 . . . . 0.0 111.264 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.97 -48.04 81.15 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.62 95.51 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.84 0.856 . . . . 0.0 111.247 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.16 -30.76 69.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.579 0.752 . . . . 0.0 110.856 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.14 7.53 10.11 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.627 1.108 . . . . 0.0 112.854 171.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -72.14 167.31 20.54 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.29 1.045 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -105.31 87.16 1.91 Allowed Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.865 1.666 . . . . 0.0 108.706 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.87 73.92 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.543 2.162 . . . . 0.0 112.668 -172.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -64.0 115.25 4.73 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.541 0.737 . . . . 0.0 109.253 172.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -41.51 -47.96 3.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.606 1.562 . . . . 0.0 112.333 -174.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.09 -56.12 16.44 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.62 0.768 . . . . 0.0 110.639 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.07 -44.16 85.3 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.555 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 mm -54.41 -53.83 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.54 0.736 . . . . 0.0 110.4 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -54.8 -52.32 63.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.966 0.507 . . . . 0.0 110.414 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -55.24 -59.98 4.03 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 122.907 0.129 . . . . 0.0 110.693 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.3 ttp -53.89 -54.83 33.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.223 0.609 . . . . 0.0 110.568 -176.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.4 mt -55.45 -50.22 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.25 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -57.86 -44.16 86.41 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.359 0.982 . . . . 0.0 111.89 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.97 -47.32 81.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.67 0.214 . . . . 0.0 110.818 177.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 31.9 mm -74.75 -35.28 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 122.136 -0.352 . . . . 0.0 111.625 -177.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -80.03 46.41 0.8 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.308 1.443 . . . . 0.0 111.909 -169.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.69 -50.71 70.08 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.599 -0.688 . . . . 0.0 110.5 -173.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.44 -31.68 11.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.48 1.512 . . . . 0.0 110.128 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -52.8 -26.14 24.74 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.918 1.723 . . . . 0.0 115.34 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.3 m 50.09 58.7 5.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.051 0.94 . . . . 0.0 111.934 172.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.12 -24.27 27.62 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 124.559 1.076 . . . . 0.0 112.265 -177.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p -125.71 122.8 37.35 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.003 0.902 . . . . 0.0 112.022 -173.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.1 mm -75.32 106.45 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.82 158.72 34.95 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.324 0.583 . . . . 0.0 109.846 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -47.74 -40.12 19.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.013 0.925 . . . . 0.0 112.573 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.65 -47.26 79.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.449 1.022 . . . . 0.0 111.727 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.97 -48.12 80.9 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.521 -0.737 . . . . 0.0 110.136 174.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -55.71 -50.68 69.69 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.09 0.471 . . . . 0.0 110.632 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.2 tp -54.18 -49.1 70.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.864 1.665 . . . . 0.0 109.935 175.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.9 m -57.77 -51.31 70.07 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.893 -0.504 . . . . 0.0 110.527 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 59.8 ttp -55.31 -50.07 70.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.941 0.496 . . . . 0.0 109.869 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -46.72 81.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.19 0.596 . . . . 0.0 110.32 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.4 m -55.3 -52.07 64.66 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.925 0.49 . . . . 0.0 109.922 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -42.48 89.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.456 0.303 . . . . 0.0 111.348 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -68.12 -40.31 82.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.641 0.776 . . . . 0.0 111.431 -178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 C--O 1.251 1.184 0 C-N-CA 124.961 1.304 . . . . 0.0 109.475 -177.362 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.391 0.139 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.77 65.71 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.462 1.105 . . . . 0.0 111.545 -177.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 157.15 -76.59 0.2 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.317 -2.313 . . . . 0.0 107.317 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 77.4 mt -73.97 77.11 1.68 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 170.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.7 p -65.72 166.11 11.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -53.96 -42.97 69.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 171.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -56.21 -49.13 74.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.915 0.486 . . . . 0.0 110.605 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -56.01 -48.97 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.704 0.684 . . . . 0.0 111.139 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -55.73 -44.18 77.3 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.287 0.494 . . . . 0.0 111.238 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -57.68 -52.87 63.67 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.777 0.831 . . . . 0.0 109.791 176.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -56.64 -47.06 80.57 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.983 -0.448 . . . . 0.0 111.314 178.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.59 -46.28 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.307 0.643 . . . . 0.0 109.731 176.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -61.84 -46.45 89.4 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.765 -0.584 . . . . 0.0 111.16 178.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -55.57 -51.44 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.865 -0.522 . . . . 0.0 110.32 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.88 67.75 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.978 0.511 . . . . 0.0 110.433 177.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -49.42 -62.58 1.47 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.126 0.571 . . . . 0.0 110.196 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -52.86 -46.2 67.74 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.472 0.709 . . . . 0.0 111.073 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 tt -56.68 -53.2 60.41 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.676 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -62.29 -37.8 86.89 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.267 0.485 . . . . 0.0 110.979 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -70.91 29.27 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.6 2.36 . . . . 0.0 113.307 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.1 p -39.01 -62.06 0.68 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 127.168 2.187 . . . . 0.0 112.051 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.74 -24.04 15.19 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.361 1.464 . . . . 0.0 110.317 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.82 -36.59 41.78 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.737 1.16 . . . . 0.0 111.689 177.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t 39.38 47.83 1.58 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 0.0 113.288 169.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 138.99 -47.99 0.89 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -173.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.0 p -136.45 123.65 21.77 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.418 0.687 . . . . 0.0 109.327 -173.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -72.08 123.9 27.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.83 147.47 41.12 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.41 -49.04 0.7 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.806 1.242 . . . . 0.0 112.8 171.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -54.2 -54.86 34.07 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.059 0.944 . . . . 0.0 110.926 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -57.84 -41.66 82.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.077 0.551 . . . . 0.0 109.84 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 tp -63.78 -46.78 83.67 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.996 -0.44 . . . . 0.0 111.247 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.257 19.9 ptpt -64.2 -36.11 82.99 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.221 -0.924 . . . . 0.0 111.556 177.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.96 -48.42 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.68 0.673 . . . . 0.0 110.105 171.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.2 -54.48 42.86 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.869 0.467 . . . . 0.0 110.493 177.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.8 mtm -53.88 -45.94 71.21 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.953 0.501 . . . . 0.0 111.43 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.24 -49.3 76.48 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.922 -0.486 . . . . 0.0 110.062 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.38 -40.12 77.48 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.784 0.434 . . . . 0.0 111.093 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.98 2.43 5.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.186 0.995 . . . . 0.0 113.027 174.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.59 18.76 65.34 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.185 0.902 . . . . 0.0 113.229 173.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -75.89 167.28 22.16 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.321 1.061 . . . . 0.0 110.092 172.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -109.52 105.85 57.74 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 169.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -56.86 71.67 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 124.887 3.724 . . . . 0.0 115.912 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -68.36 85.34 0.27 Allowed 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 169.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -31.17 -54.39 0.22 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 127.599 2.359 . . . . 0.0 113.629 -173.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -59.73 -48.73 80.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.814 0.446 . . . . 0.0 110.276 -177.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -64.6 -43.34 94.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.323 0.649 . . . . 0.0 109.68 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 mm -54.04 -52.88 32.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 123.182 0.593 . . . . 0.0 109.904 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -57.94 -48.0 81.24 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.215 0.606 . . . . 0.0 110.812 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.31 -54.94 33.49 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 33.8 ttp -56.44 -52.61 64.02 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.352 0.661 . . . . 0.0 110.361 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.5 mt -48.39 -49.57 12.95 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 123.116 0.566 . . . . 0.0 109.646 176.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -59.11 -49.38 78.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.753 -0.165 . . . . 0.0 111.397 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -56.63 -44.31 81.12 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.898 0.317 . . . . 0.0 111.368 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.0 mm -71.52 -34.96 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.692 0.397 . . . . 0.0 110.572 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -79.24 67.95 5.1 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.694 -0.629 . . . . 0.0 110.872 -174.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -49.16 -33.05 11.34 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.342 1.457 . . . . 0.0 113.705 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -87.21 -17.91 31.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.547 0.612 . . . . 0.0 110.47 -177.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.51 86.75 Favored Glycine 0 N--CA 1.441 -1.02 0 C-N-CA 125.571 1.557 . . . . 0.0 114.367 171.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.2 t -79.56 39.56 0.41 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.316 1.558 . . . . 0.0 112.233 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 45.3 29.91 2.67 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.259 1.885 . . . . 0.0 114.657 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.0 p -157.03 161.95 39.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.6 mm -101.21 106.51 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -65.66 154.82 37.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.092 0.557 . . . . 0.0 109.857 169.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -43.73 -52.06 6.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.592 0.757 . . . . 0.0 112.857 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.43 -34.04 77.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.849 0.75 . . . . 0.0 111.297 -177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -67.95 -42.43 80.96 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.467 -0.77 . . . . 0.0 109.408 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.16 -45.82 90.0 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.058 -0.401 . . . . 0.0 110.446 173.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.13 -47.8 71.49 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.354 1.062 . . . . 0.0 109.025 174.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.1 m -58.2 -49.41 77.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.934 0.494 . . . . 0.0 110.889 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -54.29 -52.71 60.59 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.86 -0.525 . . . . 0.0 110.171 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.97 -49.12 72.19 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.188 0.595 . . . . 0.0 110.044 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 66.1 m -53.71 -48.05 69.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.557 0.743 . . . . 0.0 110.745 176.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.64 -41.81 99.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.626 0.371 . . . . 0.0 111.478 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.6 -44.18 74.89 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 122.692 0.397 . . . . 0.0 111.53 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.976 -1.011 . . . . 0.0 111.053 178.903 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 . . . . . 0 N--CA 1.477 0.881 0 CA-C-O 120.396 0.141 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.7 p -146.38 155.6 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.5 -58.71 3.33 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 -174.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.7 mt -50.88 125.5 13.62 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.15 0.98 . . . . 0.0 110.276 170.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 65.8 p -65.41 160.56 21.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.786 0.434 . . . . 0.0 110.036 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -52.81 -41.86 64.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.913 0.485 . . . . 0.0 109.889 172.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -54.68 -53.59 52.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.147 0.579 . . . . 0.0 110.578 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -56.1 -45.63 79.38 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 122.04 -0.413 . . . . 0.0 110.851 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -55.8 -47.34 77.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.696 0.68 . . . . 0.0 111.112 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -56.19 -51.01 69.59 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.727 0.411 . . . . 0.0 110.277 176.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.7 -51.18 64.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.881 0.31 . . . . 0.0 110.776 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.22 -42.23 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 123.77 0.828 . . . . 0.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -58.98 -51.16 71.25 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.618 0.767 . . . . 0.0 110.167 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.15 -41.15 97.28 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.311 -0.868 . . . . 0.0 111.54 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.6 -51.76 66.06 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.016 -0.428 . . . . 0.0 110.162 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -50.66 -53.77 28.34 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.556 0.742 . . . . 0.0 110.754 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -52.68 -52.92 53.8 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.264 1.026 . . . . 0.0 110.242 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.84 -51.93 65.79 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.284 0.234 . . . . 0.0 110.854 178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -59.78 -39.41 84.8 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.419 -0.175 . . . . 0.0 110.545 -179.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.82 63.83 0.92 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.471 0.709 . . . . 0.0 109.924 172.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 77.5 p -55.46 -26.59 43.15 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.822 0.849 . . . . 0.0 111.331 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.64 -18.92 64.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.249 1.02 . . . . 0.0 111.411 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.61 21.46 67.01 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 124.308 0.956 . . . . 0.0 113.254 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 p -86.41 -12.54 48.85 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.035 0.917 . . . . 0.0 112.774 -175.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.44 16.57 60.17 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.674 1.13 . . . . 0.0 110.52 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -150.06 121.27 7.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.025 1.33 . . . . 0.0 108.45 -169.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.0 mt -81.56 114.66 22.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.16 148.33 50.23 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.906 0.775 . . . . 0.0 110.307 171.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.88 -47.99 1.1 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.053 0.941 . . . . 0.0 113.142 173.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -58.92 -46.52 87.72 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.148 0.579 . . . . 0.0 111.228 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -61.82 -41.18 97.47 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.74 -45.25 93.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.599 0.636 . . . . 0.0 110.492 176.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -54.93 -50.18 69.48 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.702 -0.624 . . . . 0.0 110.233 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.33 -48.19 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.062 0.392 . . . . 0.0 110.542 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.72 -54.83 32.44 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.197 0.599 . . . . 0.0 110.458 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.6 mtm -56.03 -42.43 76.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.831 0.852 . . . . 0.0 110.992 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -60.56 -45.51 93.61 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.834 -0.541 . . . . 0.0 110.621 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.86 -37.99 84.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.533 0.733 . . . . 0.0 111.138 175.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.0 mt -68.22 -0.42 4.67 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.949 0.899 . . . . 0.0 112.121 171.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.5 13.94 66.82 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.786 1.184 . . . . 0.0 112.399 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -79.46 161.96 25.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.291 1.045 . . . . 0.0 109.825 -176.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -105.45 93.82 7.52 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -68.46 83.87 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.133 1.888 . . . . 0.0 112.353 -173.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -60.07 90.2 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.894 1.278 . . . . 0.0 110.041 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -31.37 -59.55 0.24 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 127.353 2.261 . . . . 0.0 114.051 -170.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.4 -47.68 83.1 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.641 0.655 . . . . 0.0 111.795 -176.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -65.8 -41.41 91.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.3 mm -56.69 -50.84 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 122.794 0.438 . . . . 0.0 110.285 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -60.08 -45.34 93.26 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.441 0.564 . . . . 0.0 111.155 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -53.93 -56.62 16.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.24 0.473 . . . . 0.0 110.282 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.9 ttp -54.42 -53.45 53.99 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.978 0.511 . . . . 0.0 110.81 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.5 mt -49.66 -49.54 19.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 123.512 0.725 . . . . 0.0 109.455 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -59.13 -46.22 88.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.342 0.519 . . . . 0.0 111.522 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.12 -42.95 86.9 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.648 0.379 . . . . 0.0 111.448 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.3 mm -74.79 -34.84 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 122.049 -0.407 . . . . 0.0 111.032 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -78.36 80.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.827 0.851 . . . . 0.0 110.63 -173.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.27 -44.33 15.06 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.556 0.742 . . . . 0.0 110.878 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -118.46 -24.29 6.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.851 1.26 . . . . 0.0 112.241 -175.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.37 -17.15 61.48 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 123.664 0.649 . . . . 0.0 114.611 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.0 t 52.7 58.15 5.65 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.588 1.194 . . . . 0.0 111.932 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.33 -23.03 37.4 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.995 0.807 . . . . 0.0 111.333 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.3 p -110.49 176.55 5.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.321 0.648 . . . . 0.0 109.543 175.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.1 mm -114.79 114.96 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.986 1.714 . . . . 0.0 106.93 169.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.49 160.08 32.1 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.552 1.141 . . . . 0.0 110.534 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -52.73 -52.07 57.82 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.842 0.457 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.69 -44.72 90.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.322 0.51 . . . . 0.0 110.873 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -56.93 -51.01 70.84 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.82 -48.37 78.14 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.165 0.586 . . . . 0.0 111.287 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -58.83 -45.42 90.04 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 121.804 -0.56 . . . . 0.0 110.0 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.9 m -59.21 -52.24 66.53 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 122.083 -0.385 . . . . 0.0 110.292 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 21.2 ttt -49.21 -55.26 13.07 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.911 0.884 . . . . 0.0 109.982 175.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 44.0 tpp -54.85 -50.87 67.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.538 0.735 . . . . 0.0 110.211 -178.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 31.2 m -55.49 -46.32 76.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.091 0.557 . . . . 0.0 110.543 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.6 -42.04 95.82 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.996 0.518 . . . . 0.0 111.816 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -67.7 -45.99 73.54 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.002 0.521 . . . . 0.0 110.927 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 93.9 mtp . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.328 -1.796 . . . . 0.0 111.707 179.541 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 t 59.93 69.32 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 124.108 0.963 . . . . 0.0 109.607 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 77.8 -59.61 3.81 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -71.19 87.46 0.8 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.567 0.747 . . . . 0.0 109.732 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.6 p -63.37 164.73 8.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.87 0.468 . . . . 0.0 109.938 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -50.2 -46.91 54.83 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.942 0.497 . . . . 0.0 110.105 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -43.45 -56.29 3.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.165 1.386 . . . . 0.0 111.701 170.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -65.17 -39.75 93.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 121.962 -0.461 . . . . 0.0 110.158 -177.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -60.76 -40.49 92.67 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.647 -0.658 . . . . 0.0 111.088 175.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -57.72 -51.52 69.19 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.787 -0.571 . . . . 0.0 109.838 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.19 -48.11 68.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.064 0.393 . . . . 0.0 111.208 177.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 87.0 mt -57.93 -46.15 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 123.769 0.828 . . . . 0.0 110.042 177.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -60.44 -46.24 90.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.712 0.687 . . . . 0.0 111.014 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -57.69 -52.1 66.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.778 0.431 . . . . 0.0 110.325 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -50.21 69.94 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.746 0.418 . . . . 0.0 110.513 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -51.48 -54.9 22.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.541 0.736 . . . . 0.0 110.722 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -55.22 -49.34 72.22 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.759 0.824 . . . . 0.0 110.562 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 tt -56.06 -52.48 64.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.666 0.212 . . . . 0.0 110.656 178.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -60.13 -42.6 95.16 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.597 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -74.56 64.67 1.21 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.893 0.877 . . . . 0.0 109.735 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.1 p -56.58 -24.45 47.51 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.628 0.771 . . . . 0.0 111.923 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -72.65 -23.28 60.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.258 0.623 . . . . 0.0 111.083 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 -12.8 40.23 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.278 0.942 . . . . 0.0 114.044 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 m -82.63 44.66 0.91 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.839 1.819 . . . . 0.0 113.808 -169.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.55 26.48 15.86 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.548 1.547 . . . . 0.0 114.276 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.8 p -150.09 122.44 8.43 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.03 1.332 . . . . 0.0 109.086 -174.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -80.77 111.08 17.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -63.07 147.62 50.21 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.89 -46.81 1.35 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.507 1.123 . . . . 0.0 113.242 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.4 -48.14 82.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.959 0.504 . . . . 0.0 110.985 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -61.21 -41.52 97.0 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.43 -44.19 95.3 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.939 -0.476 . . . . 0.0 110.299 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -56.42 -49.21 75.2 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.664 -0.648 . . . . 0.0 110.482 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.9 t -54.32 -49.09 66.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.51 -56.46 16.8 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.868 0.467 . . . . 0.0 110.735 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 48.5 mtm -56.05 -44.02 78.44 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.497 0.719 . . . . 0.0 111.487 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -58.11 -51.5 69.45 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.43 78.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.342 0.657 . . . . 0.0 111.474 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -67.55 -10.89 56.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.456 1.103 . . . . 0.0 112.061 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.83 9.41 54.45 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.346 0.974 . . . . 0.0 113.242 172.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -74.15 165.35 25.31 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.7 1.25 . . . . 0.0 109.938 176.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -104.08 92.49 4.59 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.73 77.13 3.09 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 121.786 1.657 . . . . 0.0 112.384 -170.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -60.74 97.42 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.45 1.1 . . . . 0.0 110.124 173.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -31.76 -51.99 0.23 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.691 2.397 . . . . 0.0 113.903 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -58.47 -56.26 24.48 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.089 0.555 . . . . 0.0 111.441 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.71 -42.64 99.75 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.2 mm -58.25 -49.28 82.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 122.976 0.511 . . . . 0.0 110.638 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -57.63 -48.41 79.52 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.393 0.677 . . . . 0.0 109.911 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -53.73 -57.42 10.91 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -54.48 -54.01 46.63 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 110.885 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.5 mt -50.28 -47.26 25.72 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.3 0.64 . . . . 0.0 109.896 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.0 m -62.15 -42.31 99.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.086 0.403 . . . . 0.0 111.604 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.35 -47.11 86.67 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.4 0.546 . . . . 0.0 111.153 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.64 -34.71 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 122.204 -0.31 . . . . 0.0 110.947 -177.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -85.55 92.34 8.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.804 0.841 . . . . 0.0 110.104 -176.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -54.6 -23.02 15.13 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.686 1.195 . . . . 0.0 112.979 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -92.69 -14.3 28.22 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.749 0.82 . . . . 0.0 110.342 -177.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.93 28.44 48.15 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.473 1.511 . . . . 0.0 114.047 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.0 p -90.34 -3.31 57.82 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.463 1.505 . . . . 0.0 112.274 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.86 38.35 19.98 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 -176.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.8 p -140.49 128.68 22.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.529 1.132 . . . . 0.0 109.496 -175.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.4 mm -95.24 108.76 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.67 159.48 34.36 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -51.28 -51.29 55.55 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 121.901 -0.499 . . . . 0.0 111.959 -178.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -53.72 -46.36 70.76 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.933 0.397 . . . . 0.0 111.029 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.48 -47.62 83.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.901 0.48 . . . . 0.0 109.864 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -54.97 -53.2 58.8 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.149 0.58 . . . . 0.0 110.47 176.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -55.18 -47.02 75.79 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.278 0.631 . . . . 0.0 110.001 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.5 m -57.51 -49.73 75.36 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.229 -0.294 . . . . 0.0 110.564 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 53.8 ttp -55.19 -52.75 62.34 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.214 0.606 . . . . 0.0 110.302 178.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 93.6 mmm -53.61 -50.82 64.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.859 0.463 . . . . 0.0 110.134 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.8 m -54.97 -47.14 74.95 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.353 0.661 . . . . 0.0 110.785 178.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.55 94.79 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.127 0.571 . . . . 0.0 111.001 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.35 -49.22 72.52 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.686 0.221 . . . . 0.0 110.925 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.2 ptt? . . . . . 0 C--O 1.249 1.067 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.785 -179.895 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.496 0.189 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.2 t -76.68 70.97 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.06 -68.69 1.08 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -74.55 135.48 42.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.184 0.593 . . . . 0.0 109.664 173.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 m -70.59 148.59 47.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.853 0.861 . . . . 0.0 108.876 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -47.43 -43.99 24.38 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.364 0.665 . . . . 0.0 111.081 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -56.37 -42.94 78.65 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 122.033 -0.417 . . . . 0.0 111.656 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -63.81 -45.36 89.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -55.08 -48.37 73.63 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.093 0.406 . . . . 0.0 110.602 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -55.64 -53.02 61.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.945 0.898 . . . . 0.0 110.139 177.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -53.33 -47.6 69.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 110.945 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.13 -41.86 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.906 -0.496 . . . . 0.0 110.356 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -45.6 92.05 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.562 -0.711 . . . . 0.0 110.172 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -55.87 -52.75 62.98 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.359 -0.838 . . . . 0.0 110.44 176.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.65 -50.47 68.08 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.254 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -50.02 -55.7 13.68 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.322 0.649 . . . . 0.0 110.442 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -54.49 -51.52 64.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 110.629 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.2 -52.09 66.73 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.452 0.168 . . . . 0.0 110.938 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.01 -30.87 71.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.308 -0.245 . . . . 0.0 111.407 -178.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -76.31 47.18 0.45 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.833 1.253 . . . . 0.0 109.586 173.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.56 -43.47 89.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.646 1.579 . . . . 0.0 111.626 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -119.63 -24.43 6.24 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.171 0.988 . . . . 0.0 111.436 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.35 -29.1 59.93 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 123.952 0.787 . . . . 0.0 112.967 -175.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.2 m 49.67 55.78 8.86 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.199 1.399 . . . . 0.0 112.53 169.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 145.19 -51.63 0.6 Allowed Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -177.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -141.96 135.39 29.32 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.44 0.696 . . . . 0.0 109.877 -172.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 81.2 mt -74.35 112.49 11.47 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.081 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -176.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.26 146.13 48.94 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.566 0.621 . . . . 0.0 109.952 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.17 -47.77 1.19 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.758 0.823 . . . . 0.0 112.803 172.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.61 -45.36 89.36 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 111.376 177.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.1 -38.93 93.13 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.964 -0.46 . . . . 0.0 110.032 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.49 -40.23 92.83 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.725 -0.61 . . . . 0.0 110.502 176.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 tmmm? -57.29 -49.07 77.24 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.481 -0.762 . . . . 0.0 110.562 172.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.1 -50.03 47.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 118.62 0.646 . . . . 0.0 110.385 173.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.31 -55.11 27.34 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.525 0.73 . . . . 0.0 110.602 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 68.7 mtm -56.66 -41.4 77.16 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.337 0.655 . . . . 0.0 111.126 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.94 49.94 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 174.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.25 -40.2 81.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.556 0.742 . . . . 0.0 111.447 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.5 mt -68.16 -3.66 11.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.168 0.987 . . . . 0.0 112.312 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.58 24.25 56.62 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 119.372 0.987 . . . . 0.0 112.317 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.24 172.86 11.05 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -118.22 101.52 51.3 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -55.35 73.34 0.03 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 124.578 3.518 . . . . 0.0 116.704 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -68.99 90.73 0.45 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 169.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -31.61 -49.08 0.16 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.327 2.251 . . . . 0.0 113.197 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.41 -58.66 6.34 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.807 0.843 . . . . 0.0 110.758 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -67.16 -42.86 83.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.786 0.834 . . . . 0.0 109.696 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 12.3 mm -52.2 -56.11 7.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 123.568 0.747 . . . . 0.0 109.652 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.67 -51.36 69.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.342 0.657 . . . . 0.0 110.694 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -53.7 -57.19 11.74 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.806 0.275 . . . . 0.0 110.44 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.93 -53.71 52.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.581 0.752 . . . . 0.0 110.551 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 51.7 mt -50.32 -49.6 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 110.154 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -59.65 -47.28 86.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.031 0.378 . . . . 0.0 111.153 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -57.31 -44.73 84.39 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.6 0.36 . . . . 0.0 111.11 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -71.33 -34.08 52.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 O-C-N 122.196 -0.315 . . . . 0.0 110.885 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -73.63 72.51 1.45 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.028 0.931 . . . . 0.0 110.679 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -59.81 -44.24 94.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.16 0.584 . . . . 0.0 111.066 173.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -142.12 -28.27 0.62 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.943 0.897 . . . . 0.0 113.2 -169.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.21 8.86 Favored Glycine 0 CA--C 1.541 1.674 0 N-CA-C 115.699 1.04 . . . . 0.0 115.699 -173.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.3 m 50.82 70.45 0.52 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.59 1.556 . . . . 0.0 112.912 169.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.37 -27.06 8.94 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -105.43 163.64 12.48 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 117.306 0.553 . . . . 0.0 109.527 169.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.4 mm -120.37 115.31 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.101 1.761 . . . . 0.0 106.709 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -73.51 160.86 31.08 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.315 1.046 . . . . 0.0 110.512 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -49.31 -45.0 44.71 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.328 0.651 . . . . 0.0 111.97 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.5 -46.79 88.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.954 0.797 . . . . 0.0 110.927 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -61.64 -46.8 88.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.92 0.488 . . . . 0.0 109.733 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.06 -48.99 79.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.095 0.558 . . . . 0.0 110.637 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.31 -45.19 76.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.928 0.891 . . . . 0.0 109.918 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.0 m -57.26 -51.67 68.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.873 0.306 . . . . 0.0 110.274 175.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -53.56 -52.13 60.71 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.61 0.364 . . . . 0.0 110.711 177.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.7 mmm -60.61 -41.42 94.75 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.088 0.555 . . . . 0.0 111.014 -179.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 47.5 m -57.92 -45.02 87.19 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.555 -0.716 . . . . 0.0 109.481 173.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.65 59.85 1.2 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.847 0.859 . . . . 0.0 111.361 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.7 mttm 74.48 92.64 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.86 2.064 . . . . 0.0 112.182 176.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 117.077 -1.44 . . . . 0.0 111.564 174.359 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -67.26 -22.12 28.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 123.46 0.704 . . . . 0.0 112.579 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.98 -62.35 4.45 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 68.6 mt -114.15 99.39 7.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.251 1.42 . . . . 0.0 109.591 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.4 p -65.32 163.8 14.79 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.804 -0.56 . . . . 0.0 110.224 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -53.44 -34.92 59.7 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.078 0.551 . . . . 0.0 110.971 170.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -64.26 -51.47 63.4 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.226 -0.921 . . . . 0.0 109.857 176.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -55.3 -45.96 76.24 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.278 -0.264 . . . . 0.0 110.416 175.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.42 -39.61 88.04 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.519 -0.738 . . . . 0.0 111.746 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -58.82 -47.76 83.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.16 0.891 . . . . 0.0 111.025 171.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -57.3 -47.3 81.85 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.998 -0.439 . . . . 0.0 110.657 177.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.51 -43.37 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.029 0.931 . . . . 0.0 109.926 178.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -56.8 -51.92 67.06 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.571 0.623 . . . . 0.0 110.323 172.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -53.85 -53.15 56.47 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.649 0.658 . . . . 0.0 110.876 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -50.84 68.68 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.89 0.476 . . . . 0.0 110.654 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -52.64 -53.21 50.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.895 0.878 . . . . 0.0 110.331 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.0 -51.34 68.09 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.443 1.097 . . . . 0.0 110.526 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.38 -51.75 68.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.441 0.162 . . . . 0.0 110.661 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.18 -37.71 81.04 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.823 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -74.59 57.88 0.76 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.663 0.744 . . . . 0.0 109.156 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -28.44 68.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -178.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -80.23 9.15 6.04 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.332 1.053 . . . . 0.0 112.62 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 48.11 36.84 15.98 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.738 1.161 . . . . 0.0 113.437 173.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.3 m -95.57 3.83 53.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.442 1.097 . . . . 0.0 112.454 -171.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.77 14.7 58.75 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 124.008 0.813 . . . . 0.0 112.073 -174.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.3 p -154.46 134.84 13.34 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.808 -1.923 . . . . 0.0 105.808 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -85.99 105.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 169.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.22 149.35 41.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.07 -48.62 1.23 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.867 1.267 . . . . 0.0 112.881 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -57.86 -48.15 80.64 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.844 0.458 . . . . 0.0 111.033 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.77 -39.24 93.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.878 0.471 . . . . 0.0 110.128 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 tp -63.44 -41.91 98.66 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.818 -0.551 . . . . 0.0 109.869 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -59.37 -47.87 83.78 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.749 -0.594 . . . . 0.0 110.452 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.8 t -51.94 -52.02 25.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.489 0.586 . . . . 0.0 110.153 173.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.38 -53.12 55.68 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 123.246 0.619 . . . . 0.0 110.765 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.43 -40.05 85.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.443 0.697 . . . . 0.0 111.54 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.26 -51.65 68.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 172.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.96 -38.11 75.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.848 -0.533 . . . . 0.0 111.841 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -71.58 -1.58 14.03 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.419 1.088 . . . . 0.0 112.183 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 73.12 29.82 64.01 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 119.032 0.833 . . . . 0.0 112.009 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -81.55 169.73 16.73 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 117.586 0.693 . . . . 0.0 109.158 173.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 mp0 -110.54 103.42 54.19 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.808 1.243 . . . . 0.0 107.76 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -57.36 74.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.308 3.338 . . . . 0.0 115.874 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -66.15 85.26 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 169.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -31.45 -55.5 0.26 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.048 2.139 . . . . 0.0 114.031 -172.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.2 -49.1 79.13 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.883 -0.51 . . . . 0.0 111.368 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -62.86 -43.68 98.14 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.306 0.642 . . . . 0.0 109.505 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.2 mm -55.44 -53.47 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.46 0.704 . . . . 0.0 109.863 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.8 -50.93 69.15 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.556 0.342 . . . . 0.0 110.951 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -53.67 -55.5 25.47 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.39 -54.19 43.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.569 0.748 . . . . 0.0 110.732 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.8 mt -51.44 -47.29 35.75 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 -48.1 82.97 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.042 0.383 . . . . 0.0 111.298 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.26 -42.73 77.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.67 0.388 . . . . 0.0 111.178 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.8 mm -76.7 -35.17 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-N 118.068 0.395 . . . . 0.0 111.636 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -85.12 92.78 8.47 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.663 -0.648 . . . . 0.0 111.004 -171.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -21.34 53.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.897 1.279 . . . . 0.0 113.571 177.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.17 1.16 30.38 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.067 0.849 . . . . 0.0 111.029 178.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.34 -4.38 0.08 OUTLIER Glycine 0 CA--C 1.535 1.289 0 C-N-CA 126.267 1.889 . . . . 0.0 116.554 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.8 m -85.89 49.41 1.77 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.912 1.856 . . . . 0.0 110.652 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 37.59 44.22 1.25 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 126.833 2.159 . . . . 0.0 114.45 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.2 p -142.33 136.06 29.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.062 0.931 . . . . 0.0 109.589 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.4 mm -102.16 112.38 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -71.5 158.11 36.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.32 0.648 . . . . 0.0 109.924 170.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.54 -48.65 48.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.559 0.743 . . . . 0.0 112.398 177.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.7 -42.83 89.51 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.25 -0.281 . . . . 0.0 110.266 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -64.82 -46.11 83.36 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.839 0.456 . . . . 0.0 110.118 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.86 -52.71 61.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.921 0.888 . . . . 0.0 110.291 176.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.16 -48.0 79.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.172 0.589 . . . . 0.0 110.028 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.9 m -57.64 -46.54 84.03 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.805 -0.559 . . . . 0.0 110.793 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 55.6 ttp -53.16 -42.98 66.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.672 0.789 . . . . 0.0 110.465 177.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 64.2 mtt -68.3 -53.35 24.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.6 m -49.07 -43.57 41.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.448 1.099 . . . . 0.0 111.346 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.38 -36.28 68.69 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.883 0.873 . . . . 0.0 111.956 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.2 mtmm -81.72 -40.91 22.03 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 86.4 mtp . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.665 -1.16 . . . . 0.0 109.995 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.244 0.545 . . . . 0.0 111.615 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.2 m -77.14 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 125.093 1.357 . . . . 0.0 112.87 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.35 65.65 2.36 Favored Glycine 0 CA--C 1.528 0.851 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.3 mt -73.97 74.74 1.68 Allowed 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.212 -0.581 . . . . 0.0 110.921 -178.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 38.3 p -65.35 164.63 13.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.0 mp0 -55.62 -35.81 66.27 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.012 -0.43 . . . . 0.0 109.961 170.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -68.86 -45.09 71.95 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.537 -0.727 . . . . 0.0 109.969 -179.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.24 -49.74 71.23 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.336 0.516 . . . . 0.0 110.135 171.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -57.79 -47.36 82.78 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.908 -0.495 . . . . 0.0 110.898 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.04 -59.5 4.46 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.278 0.631 . . . . 0.0 110.445 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -48.13 -50.55 28.27 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.924 0.89 . . . . 0.0 111.098 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.86 -45.06 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 122.745 0.418 . . . . 0.0 110.2 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -45.91 90.41 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.779 0.718 . . . . 0.0 110.908 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -49.68 76.77 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.545 -0.722 . . . . 0.0 110.469 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.05 -48.1 73.91 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.989 0.423 . . . . 0.0 110.23 176.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -53.33 -53.33 52.57 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.512 0.725 . . . . 0.0 110.651 176.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -54.54 -50.76 67.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.439 1.096 . . . . 0.0 110.078 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.26 -53.02 62.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -61.15 -37.05 81.49 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.065 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -74.41 60.66 0.87 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.41 0.684 . . . . 0.0 109.925 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 76.4 p -53.8 -34.16 58.29 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.202 1.001 . . . . 0.0 110.819 173.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -75.02 5.32 5.33 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.857 0.863 . . . . 0.0 112.836 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 48.19 34.21 12.15 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.784 1.183 . . . . 0.0 113.475 173.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.6 m -93.49 9.01 38.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.602 0.761 . . . . 0.0 112.434 -170.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.98 18.92 35.47 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.493 1.044 . . . . 0.0 111.926 -170.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.9 p -158.76 136.63 10.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.032 -1.84 . . . . 0.0 106.032 -169.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 88.4 mt -88.12 114.98 27.58 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 174.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -62.88 146.15 53.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.644 1.111 . . . . 0.0 109.777 173.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.95 -45.48 1.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.04 0.836 . . . . 0.0 113.022 173.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.46 -46.62 88.25 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.821 -0.549 . . . . 0.0 111.165 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.01 -38.59 86.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.934 -0.479 . . . . 0.0 110.13 176.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.14 -43.2 99.35 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.809 -0.557 . . . . 0.0 110.277 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -58.54 -46.22 87.29 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.563 -0.71 . . . . 0.0 110.644 176.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.33 -45.86 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 O-C-N 122.051 -0.406 . . . . 0.0 110.498 173.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.14 -52.55 62.92 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.775 -0.578 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.02 -42.2 89.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.54 0.736 . . . . 0.0 111.347 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -55.31 -49.76 71.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.866 -0.521 . . . . 0.0 110.335 172.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.8 -38.72 86.31 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.142 0.577 . . . . 0.0 111.34 178.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 mt -68.87 -2.47 9.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.292 1.037 . . . . 0.0 112.052 173.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.4 25.49 70.36 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 119.019 0.827 . . . . 0.0 111.978 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.67 165.55 21.9 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -107.11 106.95 59.69 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 169.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -58.87 73.66 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.865 3.044 . . . . 0.0 115.096 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.96 96.3 0.59 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.492 -0.755 . . . . 0.0 109.013 173.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -31.2 -60.31 0.21 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 127.543 2.337 . . . . 0.0 114.081 -172.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -58.02 -54.76 43.25 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.09 -41.76 93.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.695 0.798 . . . . 0.0 110.447 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.8 mm -56.33 -55.61 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.135 0.574 . . . . 0.0 109.938 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -57.7 -46.02 84.91 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 122.379 -0.2 . . . . 0.0 110.84 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -55.19 -57.84 10.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.819 0.448 . . . . 0.0 109.903 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.4 ttp -54.41 -53.6 51.98 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.296 0.638 . . . . 0.0 110.233 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.33 -50.29 28.16 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.59 -44.09 89.72 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.819 0.736 . . . . 0.0 111.913 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -59.52 -39.97 85.62 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.953 -0.467 . . . . 0.0 111.386 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -80.72 -34.56 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 118.136 0.425 . . . . 0.0 111.743 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -85.86 87.61 7.44 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.163 0.985 . . . . 0.0 110.903 -169.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -91.19 -47.73 7.35 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.889 0.876 . . . . 0.0 110.586 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -109.21 -28.93 8.75 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.672 1.189 . . . . 0.0 111.286 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -56.36 -27.16 52.76 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.287 0.946 . . . . 0.0 114.582 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.8 m 50.54 58.22 5.75 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.944 1.298 . . . . 0.0 112.301 171.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 98.66 -21.38 46.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.6 p -108.03 -179.88 4.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 169.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.7 mm -122.14 119.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -74.96 158.83 32.63 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.087 0.955 . . . . 0.0 110.208 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -50.82 -47.57 60.04 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.614 0.366 . . . . 0.0 111.703 178.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.09 -45.29 87.44 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.128 0.49 . . . . 0.0 110.535 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -62.77 -46.49 87.76 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.976 0.51 . . . . 0.0 110.017 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -58.37 -48.71 79.72 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.94 0.496 . . . . 0.0 110.671 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.61 -49.05 73.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.691 0.796 . . . . 0.0 109.743 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.9 m -55.98 -49.74 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 117.957 0.344 . . . . 0.0 110.499 178.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.4 ttp -54.32 -53.86 48.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.01 0.524 . . . . 0.0 110.498 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.1 mmt -57.59 -47.95 80.71 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.523 -0.177 . . . . 0.0 110.523 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.1 m -53.59 -47.14 70.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.461 0.704 . . . . 0.0 110.345 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.61 -49.6 77.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.27 -0.269 . . . . 0.0 110.782 177.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -65.26 -51.67 59.31 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -175.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.6 mtm . . . . . 0 C--O 1.251 1.134 0 CA-C-O 117.322 -1.323 . . . . 0.0 111.939 -169.875 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 50.6 ptt85 . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 119.891 -0.1 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 t 67.88 -67.26 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.818 1.647 . . . . 0.0 111.064 179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.7 45.98 94.79 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.514 0.578 . . . . 0.0 112.162 175.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -121.29 89.47 3.13 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.969 1.308 . . . . 0.0 108.587 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.1 p -65.49 160.29 22.55 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 121.961 -0.462 . . . . 0.0 110.09 173.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -54.44 -42.12 70.22 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 172.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -52.67 -55.3 23.54 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.797 0.839 . . . . 0.0 109.858 175.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -53.86 -50.49 66.15 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 119.117 -0.468 . . . . 0.0 110.843 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.86 -47.61 73.98 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.738 0.699 . . . . 0.0 111.268 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -57.95 -50.32 73.76 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.008 0.523 . . . . 0.0 110.855 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -58.5 -47.28 84.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.111 0.414 . . . . 0.0 111.118 178.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.77 -41.59 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -62.41 -47.48 83.92 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.64 -0.663 . . . . 0.0 110.948 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -53.97 -53.47 52.35 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.91 -49.25 69.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.99 0.516 . . . . 0.0 110.466 177.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -52.49 -57.64 9.27 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.354 0.662 . . . . 0.0 110.994 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -56.86 -47.53 80.2 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.943 0.497 . . . . 0.0 110.402 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.8 tt -54.92 -53.74 51.61 Favored 'General case' 0 C--N 1.338 0.074 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -60.01 -37.78 80.75 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.172 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -73.75 61.88 0.78 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.703 0.683 . . . . 0.0 109.601 169.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 57.0 p -53.61 -37.95 63.53 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.664 1.186 . . . . 0.0 111.158 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.15 -22.44 66.37 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.78 0.432 . . . . 0.0 112.079 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.81 34.97 84.17 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 m -67.47 -25.49 65.9 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.588 0.694 . . . . 0.0 111.878 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.73 -27.99 12.27 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.303 1.43 . . . . 0.0 109.74 -169.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -130.76 147.04 52.37 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.914 2.086 . . . . 0.0 108.26 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.92 119.95 27.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.46 144.6 57.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.581 1.082 . . . . 0.0 110.1 173.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.03 -48.79 1.23 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -62.5 -43.51 98.65 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.722 -0.611 . . . . 0.0 110.945 179.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -60.17 -40.32 89.5 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.944 -0.473 . . . . 0.0 109.979 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -63.06 -43.91 97.29 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.786 -0.571 . . . . 0.0 110.223 175.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -57.48 -48.51 79.02 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.479 -0.763 . . . . 0.0 110.744 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.6 t -53.68 -50.58 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.781 0.433 . . . . 0.0 110.327 172.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.58 -53.19 49.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.117 0.567 . . . . 0.0 110.543 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 69.7 mtm -60.18 -42.71 95.58 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.356 0.662 . . . . 0.0 111.188 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -58.38 6.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.14 82.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.908 0.883 . . . . 0.0 112.19 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.94 -16.5 59.47 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.723 1.209 . . . . 0.0 111.76 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.32 24.47 12.49 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 118.637 0.653 . . . . 0.0 112.334 175.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -80.57 176.79 9.48 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -115.39 97.81 49.25 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -60.98 66.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.249 3.299 . . . . 0.0 116.684 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.64 104.99 1.13 Allowed 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.35 -0.844 . . . . 0.0 109.071 171.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -42.49 -46.83 4.94 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.525 1.53 . . . . 0.0 114.139 -170.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -59.72 -57.56 12.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.29 0.496 . . . . 0.0 110.37 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -58.32 -44.97 88.89 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.712 0.805 . . . . 0.0 109.929 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -53.43 -57.83 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.569 0.747 . . . . 0.0 110.18 175.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -57.72 -47.3 82.79 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.067 0.394 . . . . 0.0 111.097 -178.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -55.12 -58.2 8.65 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 52.7 ttp -56.1 -52.24 65.03 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.842 0.457 . . . . 0.0 110.567 -178.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 39.3 mt -49.79 -51.18 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.1 m -57.53 -49.72 75.42 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.173 0.442 . . . . 0.0 111.477 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -56.88 -43.53 81.37 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 117.838 0.29 . . . . 0.0 111.467 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 mm -71.59 -34.78 53.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 122.01 -0.431 . . . . 0.0 110.673 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -78.9 71.4 5.36 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.481 0.713 . . . . 0.0 111.682 -169.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -65.91 -46.77 77.1 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.303 0.641 . . . . 0.0 111.845 176.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -119.54 -40.06 2.82 Favored 'General case' 0 C--N 1.338 0.093 0 C-N-CA 125.423 1.489 . . . . 0.0 111.625 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -55.44 -20.07 21.38 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.468 1.033 . . . . 0.0 115.609 -169.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m 48.13 63.64 1.97 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.247 1.419 . . . . 0.0 112.623 170.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 98.85 -30.3 10.03 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -177.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -102.78 175.94 5.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.9 mm -128.33 118.44 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 175.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -77.36 170.01 17.3 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.5 0.667 . . . . 0.0 111.221 177.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.44 -36.25 73.37 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.624 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -69.43 -50.17 48.25 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.439 0.563 . . . . 0.0 109.706 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -54.11 -50.2 67.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.914 0.886 . . . . 0.0 109.92 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -56.53 -54.85 41.09 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.958 0.503 . . . . 0.0 110.747 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.08 -47.24 68.69 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.601 0.76 . . . . 0.0 110.128 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 m -56.23 -52.05 65.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.619 0.368 . . . . 0.0 110.343 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 47.5 ttp -55.2 -56.82 15.64 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.0 mmm -54.25 -45.18 72.32 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.869 0.468 . . . . 0.0 110.28 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 56.3 m -56.58 -52.52 64.52 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 174.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.21 -34.69 68.79 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.04 0.536 . . . . 0.0 112.131 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -64.22 -22.09 66.82 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.39 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-N 119.221 0.919 . . . . 0.0 110.976 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 120.479 0.18 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 m -74.04 45.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.966 1.306 . . . . 0.0 111.581 176.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.44 -68.94 0.25 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.218 0.913 . . . . 0.0 111.854 -173.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 72.9 mt -74.27 141.82 45.3 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.348 1.059 . . . . 0.0 111.978 -173.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 p -69.19 162.76 26.41 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.757 0.823 . . . . 0.0 110.015 169.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -57.55 -41.49 81.07 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 121.688 -0.632 . . . . 0.0 109.666 169.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.6 mp0 -55.18 -52.87 61.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.518 0.727 . . . . 0.0 109.973 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -55.41 -51.1 67.98 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.921 -0.487 . . . . 0.0 111.141 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.33 -41.93 90.25 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.711 0.687 . . . . 0.0 111.646 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -57.89 -53.63 56.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.114 1.366 . . . . 0.0 110.072 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -53.75 -48.7 69.44 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.234 0.614 . . . . 0.0 110.59 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.4 mt -60.35 -42.07 89.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 122.828 0.451 . . . . 0.0 110.276 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -61.35 -45.63 93.58 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.593 0.633 . . . . 0.0 110.851 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -58.04 -50.72 72.45 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.47 0.577 . . . . 0.0 110.672 177.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.55 -52.54 61.75 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -48.08 -60.15 2.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.532 0.733 . . . . 0.0 109.877 175.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -51.31 -49.18 61.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.321 1.048 . . . . 0.0 110.825 -177.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.86 -52.64 64.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.703 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -61.51 -36.37 80.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.172 0.442 . . . . 0.0 111.506 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -72.74 31.68 0.06 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.313 2.245 . . . . 0.0 113.071 -173.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.2 p -42.81 -59.42 1.97 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 127.512 2.325 . . . . 0.0 111.796 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -98.14 -25.59 14.86 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.84 1.256 . . . . 0.0 110.002 175.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.81 -31.42 54.32 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.988 1.28 . . . . 0.0 113.384 -174.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m 38.17 55.85 1.71 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.518 1.527 . . . . 0.0 114.055 169.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 124.77 -41.99 1.61 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.696 1.141 . . . . 0.0 110.825 -174.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 p -135.69 120.96 19.04 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 117.788 0.794 . . . . 0.0 110.239 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.7 mt -72.89 114.12 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.18 147.38 51.07 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.203 0.456 . . . . 0.0 110.216 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.47 -47.85 0.92 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.053 0.941 . . . . 0.0 113.178 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -58.36 -49.26 77.84 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.927 0.491 . . . . 0.0 111.168 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -59.08 -42.75 91.18 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.29 -42.34 99.27 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.966 -0.458 . . . . 0.0 110.902 177.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.02 -47.91 83.9 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.335 -0.853 . . . . 0.0 110.445 176.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.4 t -54.62 -48.62 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 173.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -53.27 55.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.862 0.465 . . . . 0.0 110.584 177.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mtm -57.95 -42.65 85.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.271 0.628 . . . . 0.0 111.599 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -56.57 -52.07 66.2 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.512 0.596 . . . . 0.0 110.116 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.49 75.57 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 122.093 -0.38 . . . . 0.0 111.64 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -72.28 -2.49 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.863 1.265 . . . . 0.0 112.355 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.49 20.94 61.07 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 119.235 0.925 . . . . 0.0 113.362 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -83.36 159.68 21.8 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.259 1.029 . . . . 0.0 109.763 171.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -104.43 98.75 15.2 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 169.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.36 80.47 1.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.357 2.038 . . . . 0.0 112.15 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -59.79 90.54 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.213 1.405 . . . . 0.0 109.518 170.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -32.39 -51.7 0.27 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.058 2.143 . . . . 0.0 115.207 -171.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -60.15 -51.31 70.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.822 0.737 . . . . 0.0 110.535 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -62.79 -41.11 99.13 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.0 mm -59.16 -47.86 88.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.936 0.494 . . . . 0.0 110.562 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.67 -48.17 81.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.852 0.751 . . . . 0.0 110.453 177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -54.7 -58.06 9.01 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -48.35 -59.61 3.32 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.421 1.488 . . . . 0.0 110.713 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.7 mt -51.38 -49.27 32.2 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 C-N-CA 123.472 0.709 . . . . 0.0 109.907 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.2 m -60.06 -47.1 87.28 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.582 0.628 . . . . 0.0 111.592 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.8 -45.49 85.99 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.483 0.313 . . . . 0.0 110.885 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.0 mm -71.65 -35.6 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 111.168 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -82.2 75.25 9.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.54 -0.725 . . . . 0.0 110.507 -170.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -58.22 -15.33 9.56 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 0.0 113.11 172.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -91.08 -13.9 32.27 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.773 1.229 . . . . 0.0 110.214 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.48 35.99 45.88 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 126.259 1.885 . . . . 0.0 114.219 175.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -100.53 -7.82 23.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.814 1.246 . . . . 0.0 112.499 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.21 21.25 67.95 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -169.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p -136.1 150.01 48.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.93 0.892 . . . . 0.0 108.931 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.3 mm -109.11 110.24 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 125.006 1.322 . . . . 0.0 108.102 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.21 152.09 45.58 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 171.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.7 -44.77 13.81 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -59.5 -46.8 87.8 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.489 0.586 . . . . 0.0 110.921 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -62.84 -45.95 90.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.019 0.528 . . . . 0.0 109.731 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -56.48 -50.81 70.65 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 123.7 0.8 . . . . 0.0 110.628 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.98 -46.91 84.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.723 0.809 . . . . 0.0 109.709 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.1 m -56.54 -53.7 54.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 117.832 0.287 . . . . 0.0 110.346 177.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -51.33 -53.96 31.0 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.095 0.958 . . . . 0.0 110.053 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.7 tpt -61.29 -44.11 97.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.024 0.53 . . . . 0.0 110.411 -176.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.0 m -56.65 -50.72 71.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 175.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.42 91.28 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.753 0.421 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.68 -45.34 94.4 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.641 0.776 . . . . 0.0 110.548 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 89.6 mmm . . . . . 0 C--O 1.251 1.133 0 CA-C-O 117.194 -1.384 . . . . 0.0 109.914 179.82 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -75.63 166.01 2.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 70.37 -166.29 50.97 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.2 mt -77.04 95.58 4.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.997 0.427 . . . . 0.0 111.045 -176.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.6 p -65.51 161.03 20.96 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.318 0.647 . . . . 0.0 109.389 169.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -56.06 -37.82 69.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.418 -0.801 . . . . 0.0 110.654 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -56.41 -53.66 54.82 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.169 0.588 . . . . 0.0 110.415 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -55.65 -44.87 77.59 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 175.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -53.59 -43.72 68.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.875 0.47 . . . . 0.0 111.243 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -58.26 -53.23 60.61 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -55.26 -44.35 75.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.543 0.211 . . . . 0.0 111.22 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.47 -45.31 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.016 0.926 . . . . 0.0 109.8 178.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -57.45 -52.47 65.24 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.283 0.492 . . . . 0.0 110.604 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -54.45 -50.84 66.75 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.483 -0.761 . . . . 0.0 111.221 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.8 72.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.195 0.598 . . . . 0.0 110.559 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -52.41 -53.68 41.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.704 0.801 . . . . 0.0 110.311 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -56.49 -50.65 71.16 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.254 0.621 . . . . 0.0 110.211 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.1 tt -57.18 -52.23 66.16 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -60.45 -39.07 86.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.113 0.165 . . . . 0.0 110.595 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -74.25 58.14 0.7 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -31.93 71.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.343 1.057 . . . . 0.0 110.684 -173.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -67.97 -22.39 65.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 112.383 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.26 36.13 51.25 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -77.94 1.66 19.94 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.453 1.101 . . . . 0.0 113.136 177.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.95 11.01 42.43 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.538 1.542 . . . . 0.0 112.427 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.1 p -158.18 143.65 16.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 -169.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.7 mt -87.89 110.81 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.07 147.28 44.33 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.459 1.027 . . . . 0.0 110.324 175.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.43 -48.54 1.96 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.907 0.776 . . . . 0.0 113.037 173.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -59.3 -45.93 89.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.836 0.454 . . . . 0.0 110.996 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.22 -36.59 82.44 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.992 -0.442 . . . . 0.0 110.517 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.89 -41.89 90.97 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.651 -0.655 . . . . 0.0 110.069 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -57.89 -49.45 76.67 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.738 -0.601 . . . . 0.0 110.294 173.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 38.5 t -51.98 -51.37 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.066 0.394 . . . . 0.0 110.16 173.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -55.9 21.97 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.721 0.808 . . . . 0.0 110.743 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.6 mtm -54.84 -45.72 74.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.36 0.664 . . . . 0.0 110.99 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -58.22 -48.01 81.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.756 -0.59 . . . . 0.0 110.444 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.16 79.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.978 0.511 . . . . 0.0 111.35 176.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -70.1 -0.47 7.77 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.532 1.133 . . . . 0.0 112.222 174.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.81 16.76 62.87 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-N 119.117 0.872 . . . . 0.0 112.771 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -75.93 162.05 28.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.267 1.033 . . . . 0.0 109.436 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -108.19 105.77 57.21 Favored Pre-proline 0 N--CA 1.449 -0.506 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -56.13 78.5 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.312 3.341 . . . . 0.0 115.253 -178.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.35 81.37 0.09 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.161 0.984 . . . . 0.0 108.933 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -31.72 -56.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 127.329 2.252 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.98 -50.89 67.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.971 0.415 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.65 -40.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.07 0.548 . . . . 0.0 109.692 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.1 mm -53.64 -54.78 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -56.09 -52.67 63.46 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.673 0.789 . . . . 0.0 109.775 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -52.44 -57.86 8.54 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.897 0.479 . . . . 0.0 110.308 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -51.76 -54.46 28.34 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.8 0.84 . . . . 0.0 110.582 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.4 mt -51.61 -49.67 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -57.06 -48.1 79.37 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.056 0.389 . . . . 0.0 111.419 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -58.96 -42.35 89.68 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.94 0.337 . . . . 0.0 111.094 178.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.06 -31.32 44.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 O-C-N 122.156 -0.34 . . . . 0.0 111.231 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.37 75.74 0.54 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.855 0.862 . . . . 0.0 111.635 -173.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -81.96 -35.92 28.49 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.907 1.683 . . . . 0.0 109.848 171.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -152.54 31.18 0.52 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.66 1.584 . . . . 0.0 109.316 -172.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.5 -37.64 3.46 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.205 0.907 . . . . 0.0 111.757 -170.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.6 p 45.08 56.75 5.2 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.857 1.263 . . . . 0.0 111.49 -176.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.26 -10.63 68.17 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-O 119.462 -0.632 . . . . 0.0 113.252 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 p -113.99 171.8 7.38 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.138 0.969 . . . . 0.0 108.815 169.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.6 mm -112.05 116.22 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 169.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.96 156.54 39.49 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.429 0.692 . . . . 0.0 109.783 174.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -51.99 -43.45 63.62 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.904 -0.497 . . . . 0.0 111.728 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -57.45 -46.38 83.68 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.354 0.524 . . . . 0.0 110.66 178.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.15 -47.42 82.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.753 0.421 . . . . 0.0 110.113 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -57.02 -51.71 68.16 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.691 0.758 . . . . 0.0 110.304 178.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.2 tp -52.87 -46.27 67.8 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.957 0.903 . . . . 0.0 110.044 174.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 59.2 m -58.3 -47.85 82.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.319 0.509 . . . . 0.0 111.192 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 77.5 mtp -53.26 -51.29 62.71 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.695 0.679 . . . . 0.0 109.827 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.59 -41.28 94.38 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.862 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.8 m -60.93 -44.63 96.94 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.223 0.609 . . . . 0.0 109.981 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.19 93.18 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.512 0.325 . . . . 0.0 110.519 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.77 -42.34 90.98 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 176.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 67.3 mtm . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.266 -1.349 . . . . 0.0 110.705 -178.155 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -45.37 -45.51 12.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.907 0.883 . . . . 0.0 111.863 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -55.95 -47.44 77.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.908 0.483 . . . . 0.0 110.834 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -61.99 -43.97 97.71 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.24 -44.11 92.35 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.233 -0.292 . . . . 0.0 110.849 178.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -57.86 -51.78 68.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.209 0.604 . . . . 0.0 110.006 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -52.96 -50.23 64.51 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.128 0.422 . . . . 0.0 111.058 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.76 -46.09 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 124.023 0.929 . . . . 0.0 110.377 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -61.17 -49.18 78.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.796 -0.565 . . . . 0.0 111.067 177.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -55.83 -52.27 64.58 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.568 -0.708 . . . . 0.0 110.569 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.82 75.25 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.389 0.676 . . . . 0.0 110.554 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.8 -55.52 22.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.553 0.741 . . . . 0.0 110.225 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.64 -50.24 70.73 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.856 0.463 . . . . 0.0 110.24 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 tt -55.8 -53.5 55.89 Favored 'General case' 0 N--CA 1.457 -0.099 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -59.91 -36.86 77.88 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 119.49 -0.29 . . . . 0.0 110.941 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -73.83 60.85 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.458 0.572 . . . . 0.0 109.992 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 p . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.481 1.113 . . . . 0.0 111.175 178.078 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.983 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -138.27 144.99 40.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.952 1.701 . . . . 0.0 107.09 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.5 mt -80.82 116.81 25.73 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.062 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -65.98 147.44 53.35 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.11 0.868 . . . . 0.0 110.3 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.76 -46.76 1.3 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.782 0.833 . . . . 0.0 113.213 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.02 -46.41 89.58 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.806 -0.559 . . . . 0.0 111.233 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.51 -38.81 88.72 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.014 -0.429 . . . . 0.0 109.904 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.8 -43.49 98.66 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.843 -0.536 . . . . 0.0 110.389 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -57.02 -48.75 77.75 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.474 -0.766 . . . . 0.0 110.096 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -55.05 -48.03 76.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.731 -0.605 . . . . 0.0 110.551 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.85 70.48 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.873 0.469 . . . . 0.0 110.633 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.3 mtm -61.6 -38.03 86.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.737 -0.602 . . . . 0.0 111.583 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -60.94 -43.41 98.71 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.464 -0.773 . . . . 0.0 111.355 169.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.45 77.09 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.023 0.829 . . . . 0.0 111.331 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.47 -0.62 13.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.088 0.955 . . . . 0.0 112.501 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.66 24.05 68.46 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.406 1.003 . . . . 0.0 112.709 175.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -80.03 165.95 22.03 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.084 0.942 . . . . 0.0 110.525 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -116.19 92.85 37.24 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.737 1.615 . . . . 0.0 107.835 170.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -53.17 140.08 61.63 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.952 3.101 . . . . 0.0 112.98 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -135.95 119.17 16.63 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -40.31 -58.52 1.5 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.289 1.436 . . . . 0.0 114.633 -169.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -51.41 69.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.774 0.43 . . . . 0.0 111.674 -177.048 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -57.45 -50.69 72.19 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.921 0.488 . . . . 0.0 110.038 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.76 -54.22 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 123.998 0.919 . . . . 0.0 109.786 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -55.44 -50.95 68.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.444 0.697 . . . . 0.0 110.593 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.7 -51.45 67.15 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -177.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.77 -53.29 56.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.222 0.609 . . . . 0.0 110.071 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -50.67 -49.37 25.7 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.783 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -58.64 -44.73 90.16 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.566 1.075 . . . . 0.0 111.471 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -58.67 -47.78 83.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.432 0.293 . . . . 0.0 110.744 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 34.6 mm -71.6 -34.66 53.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 120.716 0.293 . . . . 0.0 110.772 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -81.08 70.45 7.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 109.442 -174.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 CA--C 1.534 0.335 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.244 173.691 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.878 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -113.54 166.46 11.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.6 mm -118.54 116.88 52.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 125.622 1.569 . . . . 0.0 107.142 176.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.16 160.6 32.17 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.561 1.144 . . . . 0.0 110.651 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -48.68 -48.72 39.83 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.368 0.667 . . . . 0.0 111.781 176.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -63.93 -40.65 96.94 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.787 0.721 . . . . 0.0 111.356 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -62.77 -47.46 83.39 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.68 -0.638 . . . . 0.0 109.654 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -59.31 -46.63 88.06 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.415 0.686 . . . . 0.0 110.715 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.16 -48.17 74.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.693 1.197 . . . . 0.0 109.509 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.3 m -56.75 -51.09 70.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.288 0.494 . . . . 0.0 110.432 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.7 ttp -51.8 -52.08 51.69 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 176.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 C-N-CA 123.092 0.557 . . . . 0.0 111.077 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.7 p . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.984 0.421 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -50.81 -47.14 60.06 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.43 -52.38 46.67 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.352 0.661 . . . . 0.0 110.677 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -57.45 -48.52 78.96 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.147 -0.346 . . . . 0.0 110.62 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -58.52 -40.49 83.07 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.602 0.637 . . . . 0.0 111.707 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -58.33 -52.66 64.68 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.51 0.724 . . . . 0.0 109.838 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.43 -45.97 87.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.202 -0.311 . . . . 0.0 111.352 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.47 -46.45 82.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.729 0.812 . . . . 0.0 109.597 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -61.64 -44.95 96.01 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.383 0.538 . . . . 0.0 111.013 177.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -55.88 -55.25 34.86 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.456 0.571 . . . . 0.0 110.114 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.77 -49.46 70.83 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.871 0.468 . . . . 0.0 110.03 178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -51.82 -52.68 47.46 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.887 0.475 . . . . 0.0 110.733 177.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.53 -49.17 75.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.755 0.822 . . . . 0.0 110.606 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 tp -53.37 -54.77 31.83 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -61.58 -43.05 99.58 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.456 -0.152 . . . . 0.0 110.909 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.99 62.69 1.15 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.696 1.198 . . . . 0.0 109.547 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 75.0 p . . . . . 0 CA--C 1.534 0.358 0 C-N-CA 124.131 0.972 . . . . 0.0 111.169 173.83 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.096 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.3 p -148.33 121.71 9.05 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.109 1.764 . . . . 0.0 107.536 -169.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.37 110.38 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 169.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.73 148.68 45.97 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.24 -46.24 1.49 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.551 1.14 . . . . 0.0 113.062 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -59.18 -48.03 83.12 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.061 0.457 . . . . 0.0 110.926 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -61.51 -39.69 91.9 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 122.017 -0.427 . . . . 0.0 109.942 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.2 tp -63.56 -42.56 98.34 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.611 -0.681 . . . . 0.0 110.383 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.74 -48.04 80.75 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.687 -0.633 . . . . 0.0 110.168 175.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -54.23 -49.46 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 122.014 -0.429 . . . . 0.0 110.554 173.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.79 -49.08 69.1 Favored 'General case' 0 C--O 1.225 -0.204 0 O-C-N 121.993 -0.442 . . . . 0.0 110.675 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -61.13 -39.88 91.7 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.084 0.554 . . . . 0.0 111.382 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -60.13 -43.35 95.73 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.245 -0.91 . . . . 0.0 111.437 170.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.85 -37.77 77.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.951 0.796 . . . . 0.0 111.346 173.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -72.82 -0.84 14.52 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.042 0.937 . . . . 0.0 112.647 173.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.43 25.67 69.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.318 0.961 . . . . 0.0 112.616 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -82.55 167.06 18.72 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 117.791 0.796 . . . . 0.0 111.035 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -109.35 107.23 59.5 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 169.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -56.87 77.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.638 3.559 . . . . 0.0 114.459 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -65.84 82.5 0.07 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.364 1.066 . . . . 0.0 109.044 170.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -31.29 -55.4 0.24 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 127.817 2.447 . . . . 0.0 114.288 -169.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 mp0 -59.33 -53.27 60.15 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.33 0.586 . . . . 0.0 110.134 -176.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -62.68 -41.66 99.22 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.764 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.99 -52.83 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.095 0.558 . . . . 0.0 109.89 174.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -51.3 70.15 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -53.34 -56.12 19.31 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.483 0.313 . . . . 0.0 110.577 178.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.0 ttp -50.89 -57.92 7.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.303 0.641 . . . . 0.0 110.103 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -51.47 -44.22 32.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 122.724 0.41 . . . . 0.0 110.022 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.2 m -61.75 -49.44 76.41 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.185 0.448 . . . . 0.0 111.558 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -58.09 -45.22 87.53 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.055 0.389 . . . . 0.0 110.848 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.02 -34.21 49.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.241 -0.287 . . . . 0.0 111.101 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -89.46 88.45 7.46 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.65 0.659 . . . . 0.0 110.35 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 123.72 0.808 . . . . 0.0 112.246 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.1 0 CA-C-O 120.075 -0.292 . . . . 0.0 113.059 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.0 p -137.62 124.62 21.43 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.746 1.219 . . . . 0.0 109.602 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.5 mm -91.59 104.34 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.83 151.3 39.37 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -45.41 -47.98 13.64 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.39 -42.35 86.91 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.499 0.591 . . . . 0.0 111.202 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -66.1 -45.38 81.39 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -55.9 -49.94 72.04 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.697 0.399 . . . . 0.0 110.439 174.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -54.28 -49.75 68.89 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 108.902 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.6 m -55.85 -49.68 72.67 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.932 -0.48 . . . . 0.0 111.087 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.7 ttp -54.0 -51.54 63.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.827 -0.545 . . . . 0.0 110.156 177.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 91.4 mmm . . . . . 0 CA--C 1.535 0.373 0 O-C-N 122.026 -0.422 . . . . 0.0 111.559 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p . . . . . 0 N--CA 1.452 -0.332 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -53.32 -36.07 60.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.166 -0.334 . . . . 0.0 110.112 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.92 -58.12 9.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.948 0.499 . . . . 0.0 110.307 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -52.67 -47.61 67.05 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.86 -0.525 . . . . 0.0 110.685 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -57.61 -44.57 85.56 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.228 -0.295 . . . . 0.0 110.802 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.07 88.11 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.902 -0.499 . . . . 0.0 110.25 177.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -58.13 -48.89 78.83 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 110.225 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -58.58 -41.27 81.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -61.84 -47.7 83.91 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.728 -0.607 . . . . 0.0 111.237 175.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -56.8 -49.31 75.74 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.73 0.695 . . . . 0.0 110.38 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.05 -50.01 67.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.559 0.344 . . . . 0.0 110.736 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -51.77 -57.5 9.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.343 0.657 . . . . 0.0 110.725 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -57.54 -45.71 84.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 110.69 -177.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 tt -56.24 -53.16 60.51 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.0 -37.34 79.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.746 -0.168 . . . . 0.0 110.907 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -73.66 59.82 0.66 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.174 0.443 . . . . 0.0 110.283 170.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 68.2 p . . . . . 0 CA--C 1.533 0.309 0 C-N-CA 124.37 1.068 . . . . 0.0 111.158 176.829 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.979 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p -141.0 145.5 36.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.313 1.845 . . . . 0.0 106.653 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 95.1 mt -82.87 120.08 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.15 146.26 53.59 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.422 1.01 . . . . 0.0 110.426 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.49 -48.33 0.97 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.895 0.878 . . . . 0.0 113.192 173.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.28 -48.27 81.01 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.939 0.496 . . . . 0.0 111.217 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -60.72 -39.51 88.89 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.766 0.426 . . . . 0.0 110.118 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.02 -40.86 99.03 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.869 -0.52 . . . . 0.0 110.549 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -61.07 -47.28 87.09 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.626 -0.671 . . . . 0.0 110.67 174.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -52.86 -50.47 43.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.446 0.566 . . . . 0.0 110.145 173.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.53 -53.65 48.58 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.16 0.584 . . . . 0.0 110.408 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.8 mtm -56.35 -46.1 80.15 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.387 0.675 . . . . 0.0 111.874 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -54.46 -51.02 66.32 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.437 0.562 . . . . 0.0 110.726 172.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.77 73.8 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.966 -0.459 . . . . 0.0 111.763 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.5 mt -74.99 -0.58 19.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.764 1.226 . . . . 0.0 112.258 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.75 25.05 63.41 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 119.189 0.904 . . . . 0.0 112.878 176.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -76.8 166.19 23.68 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.953 0.876 . . . . 0.0 109.259 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -108.77 109.93 61.19 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -58.48 66.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 124.764 3.643 . . . . 0.0 115.94 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.94 90.16 0.43 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 171.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -31.42 -52.28 0.21 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.97 2.108 . . . . 0.0 113.966 -172.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -62.12 -49.11 77.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.341 0.656 . . . . 0.0 110.639 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.68 -47.45 86.2 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.984 0.913 . . . . 0.0 109.307 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.7 mm -54.7 -53.64 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -57.58 -49.39 76.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.615 0.766 . . . . 0.0 110.387 -179.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -54.81 -56.91 14.29 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.453 0.301 . . . . 0.0 110.257 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.3 ttp -51.74 -56.97 10.66 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.793 0.437 . . . . 0.0 110.355 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.51 -50.6 21.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 123.047 0.539 . . . . 0.0 109.631 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.6 m -58.5 -49.07 78.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.312 0.505 . . . . 0.0 111.447 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -56.78 -44.76 82.17 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.85 0.296 . . . . 0.0 111.079 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.3 mm -71.51 -35.09 55.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 121.997 -0.44 . . . . 0.0 111.118 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -80.12 73.92 6.93 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.563 0.745 . . . . 0.0 110.744 -170.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm . . . . . 0 CA--C 1.537 0.449 0 C-N-CA 123.232 0.613 . . . . 0.0 111.727 173.49 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.845 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.6 p -105.95 170.24 8.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -121.46 119.21 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.671 1.588 . . . . 0.0 107.153 177.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.2 157.51 37.6 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.751 0.82 . . . . 0.0 110.479 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -47.14 -50.15 20.91 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 123.515 0.726 . . . . 0.0 112.081 177.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -61.11 -39.81 91.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.41 0.55 . . . . 0.0 111.203 -178.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -66.38 -46.64 75.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.671 0.789 . . . . 0.0 109.75 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -56.4 -46.97 79.91 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.17 0.588 . . . . 0.0 110.331 174.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.68 -45.73 81.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.643 0.777 . . . . 0.0 109.213 176.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.9 m -53.43 -54.24 39.74 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.797 -0.564 . . . . 0.0 110.879 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -53.62 -51.85 61.73 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.081 0.552 . . . . 0.0 110.15 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.452 -0.363 0 C-N-CA 123.279 0.632 . . . . 0.0 110.06 -179.672 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 59.9 p . . . . . 0 N--CA 1.453 -0.314 0 CA-C-O 121.364 0.602 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -55.16 -42.63 73.35 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 169.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.61 -57.45 8.19 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.834 0.854 . . . . 0.0 110.485 173.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -56.0 -49.12 74.51 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.155 -0.34 . . . . 0.0 111.29 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -60.37 -40.88 92.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.173 -179.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -58.37 -52.02 67.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.1 0.409 . . . . 0.0 110.748 172.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -50.78 -49.47 58.2 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.564 0.62 . . . . 0.0 110.595 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.25 -45.08 93.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 122.976 0.51 . . . . 0.0 110.395 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.04 95.8 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 111.885 178.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -44.38 70.82 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 109.951 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.16 -49.38 71.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.898 -0.501 . . . . 0.0 109.854 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -52.42 -51.44 59.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.274 0.63 . . . . 0.0 110.357 175.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -52.87 -53.17 52.89 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.839 0.455 . . . . 0.0 111.211 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -53.88 -53.82 47.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.947 0.499 . . . . 0.0 109.848 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -59.62 -39.19 83.48 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.812 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -73.57 60.61 0.67 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.37 0.532 . . . . 0.0 109.97 171.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.8 p . . . . . 0 CA--C 1.531 0.218 0 C-N-CA 124.945 1.298 . . . . 0.0 111.58 -179.266 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.836 0 N-CA-C 109.851 -1.3 . . . . 0.0 109.851 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.0 p -116.19 142.25 47.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.395 1.478 . . . . 0.0 109.06 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.0 mt -74.36 124.19 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.078 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -71.53 147.07 48.07 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.009 0.822 . . . . 0.0 110.193 172.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.0 -49.4 0.82 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.158 0.983 . . . . 0.0 113.317 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.46 -46.18 87.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.845 -0.534 . . . . 0.0 111.163 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.54 -39.36 93.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.67 0.388 . . . . 0.0 110.192 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.05 -44.3 96.98 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.757 -0.59 . . . . 0.0 110.016 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.54 -46.84 85.99 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.44 -0.787 . . . . 0.0 110.918 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -52.7 -51.9 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 118.3 0.5 . . . . 0.0 110.113 171.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.03 -53.86 43.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.837 0.455 . . . . 0.0 110.594 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.8 mtm -60.47 -41.45 94.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.153 0.581 . . . . 0.0 111.666 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.65 -48.36 79.67 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.22 -37.95 81.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.16 0.584 . . . . 0.0 111.626 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.0 mt -69.5 -1.31 8.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.202 1.001 . . . . 0.0 111.936 173.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.33 8.26 74.95 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.49 1.043 . . . . 0.0 112.504 174.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -73.79 162.63 28.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.557 1.178 . . . . 0.0 109.1 -177.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -104.73 91.76 4.49 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.35 75.48 2.41 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.14 1.893 . . . . 0.0 112.794 -173.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -64.85 123.08 18.45 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.716 0.806 . . . . 0.0 109.736 171.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -42.16 -59.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.83 1.652 . . . . 0.0 113.298 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mp0 -61.26 -49.87 75.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.365 0.602 . . . . 0.0 109.999 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -57.83 -47.27 83.14 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.159 0.984 . . . . 0.0 109.452 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.6 mm -61.97 -46.67 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 122.804 0.441 . . . . 0.0 110.897 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -56.53 -48.73 76.65 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.561 0.618 . . . . 0.0 110.141 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -57.07 -56.31 23.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.41 0.284 . . . . 0.0 110.421 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -49.67 -57.66 6.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.395 1.478 . . . . 0.0 110.995 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.1 mt -51.67 -50.94 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 123.233 0.613 . . . . 0.0 109.66 177.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.7 m -57.87 -46.19 85.24 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.551 0.614 . . . . 0.0 111.825 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -57.23 -46.25 83.14 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 117.841 0.292 . . . . 0.0 110.931 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.72 -34.66 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 122.336 -0.228 . . . . 0.0 111.285 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -77.01 75.91 3.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.331 0.652 . . . . 0.0 111.014 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 123.162 0.585 . . . . 0.0 110.822 173.46 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.884 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 p -102.85 175.67 5.41 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.4 mm -125.52 118.59 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.938 1.695 . . . . 0.0 106.945 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.5 158.88 34.07 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.963 0.905 . . . . 0.0 110.679 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -48.8 -48.18 41.55 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 123.246 0.618 . . . . 0.0 111.551 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -59.85 -48.32 82.15 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.393 0.542 . . . . 0.0 110.877 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.01 -47.25 83.62 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.923 0.489 . . . . 0.0 109.848 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -58.06 -49.38 77.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.324 0.65 . . . . 0.0 111.223 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.39 -47.33 79.17 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.605 0.762 . . . . 0.0 109.041 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.1 m -57.17 -52.16 66.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.897 0.479 . . . . 0.0 110.397 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -52.64 -53.99 39.43 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.979 0.911 . . . . 0.0 110.222 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.451 -0.42 0 C-N-CA 123.829 0.852 . . . . 0.0 109.681 -179.469 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.0 p . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 121.304 0.574 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -52.9 -45.65 67.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 121.768 -0.583 . . . . 0.0 109.947 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.09 -56.84 10.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.681 0.792 . . . . 0.0 110.214 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.55 -44.35 72.8 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 119.563 -0.256 . . . . 0.0 111.056 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -60.79 -39.56 89.35 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.73 0.695 . . . . 0.0 111.834 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -61.81 -49.61 75.64 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.657 0.662 . . . . 0.0 109.42 175.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -53.44 -48.89 68.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.622 0.369 . . . . 0.0 110.459 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -57.49 -44.91 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.937 0.895 . . . . 0.0 110.365 176.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -59.3 -51.65 69.02 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.438 0.563 . . . . 0.0 110.944 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -57.59 -47.38 82.29 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.055 -0.403 . . . . 0.0 110.596 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.94 -52.81 59.44 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.777 0.431 . . . . 0.0 110.306 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.12 -54.84 21.41 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 121.302 0.573 . . . . 0.0 110.469 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.16 -49.77 71.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.984 0.914 . . . . 0.0 110.424 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.03 -53.25 60.23 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.066 0.547 . . . . 0.0 110.502 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -59.5 -34.37 72.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.265 -176.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.04 58.48 0.49 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.516 0.598 . . . . 0.0 110.536 170.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 69.3 p . . . . . 0 CA--C 1.532 0.269 0 C-N-CA 124.58 1.152 . . . . 0.0 110.998 178.123 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.763 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -106.18 145.06 32.0 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.284 1.433 . . . . 0.0 108.561 171.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.3 mt -78.0 121.0 29.84 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.67 146.57 54.64 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.971 0.805 . . . . 0.0 110.427 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.94 -48.93 1.64 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.784 0.834 . . . . 0.0 113.023 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -60.64 -45.14 95.2 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.994 0.518 . . . . 0.0 111.23 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -60.28 -42.45 95.46 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.64 -43.15 99.4 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.566 0.621 . . . . 0.0 110.487 176.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.03 -47.64 84.5 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.553 -0.717 . . . . 0.0 110.864 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.33 -42.42 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 122.895 0.478 . . . . 0.0 110.595 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.84 -54.98 40.77 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.575 -0.703 . . . . 0.0 110.252 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 63.3 mtm -56.46 -47.29 79.5 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.359 0.664 . . . . 0.0 110.736 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -49.81 -55.05 15.63 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.388 0.275 . . . . 0.0 110.591 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.35 81.65 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.615 0.766 . . . . 0.0 111.624 179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.0 mt -66.66 -6.32 15.07 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 112.053 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.28 15.92 45.74 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 118.983 0.811 . . . . 0.0 112.449 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -76.45 165.94 24.11 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.126 0.963 . . . . 0.0 109.437 172.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -113.57 97.9 45.25 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 105.445 -2.057 . . . . 0.0 105.445 169.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -54.47 88.28 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.837 3.025 . . . . 0.0 115.208 -173.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -66.52 82.38 0.1 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.069 0.948 . . . . 0.0 109.828 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -30.96 -58.49 0.22 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.605 2.362 . . . . 0.0 114.44 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -62.29 -51.33 68.1 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.856 -0.528 . . . . 0.0 110.568 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -59.84 -44.73 93.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.521 0.728 . . . . 0.0 110.145 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -53.2 -54.57 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.911 0.884 . . . . 0.0 109.924 175.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -57.61 -48.37 79.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.825 0.45 . . . . 0.0 110.898 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -55.84 -55.18 35.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.696 0.226 . . . . 0.0 110.499 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 48.7 ttp -53.35 -55.26 26.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.29 0.636 . . . . 0.0 110.238 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.3 mt -49.02 -50.54 14.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 123.219 0.608 . . . . 0.0 109.598 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -58.51 -48.31 81.26 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.47 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.88 -42.35 84.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.767 0.427 . . . . 0.0 111.362 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 51.6 mm -74.07 -34.46 38.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 117.966 0.348 . . . . 0.0 111.031 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -76.5 75.45 3.23 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.472 1.109 . . . . 0.0 110.029 -177.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -172.665 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.259 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.7 p -138.74 159.23 42.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.66 0.784 . . . . 0.0 110.396 -173.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.9 mm -111.49 120.38 61.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.358 1.463 . . . . 0.0 108.299 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.37 153.94 35.34 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.31 0.644 . . . . 0.0 110.397 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -50.66 -43.37 57.28 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.346 0.658 . . . . 0.0 112.34 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.9 -45.61 93.93 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.472 0.578 . . . . 0.0 110.759 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -62.14 -46.85 87.15 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -56.41 -50.42 71.67 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.774 0.83 . . . . 0.0 110.877 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.3 tp -57.62 -44.64 85.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.44 0.696 . . . . 0.0 109.995 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.4 m -58.54 -50.07 75.11 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.951 -0.468 . . . . 0.0 110.378 176.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -54.98 -47.0 75.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.838 0.855 . . . . 0.0 110.521 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt . . . . . 0 N--CA 1.454 -0.265 0 O-C-N 122.135 -0.353 . . . . 0.0 110.521 173.23 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.2 p . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -52.18 -45.76 65.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.884 -0.51 . . . . 0.0 110.58 172.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -53.29 -55.69 22.58 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.711 0.805 . . . . 0.0 110.389 176.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -55.05 -44.31 74.59 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.488 -0.292 . . . . 0.0 110.563 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -60.0 -39.25 85.12 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.818 0.735 . . . . 0.0 111.659 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -62.16 -50.27 72.51 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.188 0.903 . . . . 0.0 109.721 176.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -53.48 -49.61 67.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.033 0.445 . . . . 0.0 110.172 177.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.3 mt -60.89 -41.34 88.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.49 1.116 . . . . 0.0 110.435 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.11 -47.14 85.91 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.878 0.763 . . . . 0.0 110.683 175.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -55.95 -54.68 41.82 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.73 -49.23 68.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.165 0.586 . . . . 0.0 110.446 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -52.22 -56.08 17.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.894 0.878 . . . . 0.0 110.702 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -54.5 -49.97 68.92 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 110.583 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -56.39 -53.85 52.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.198 0.199 . . . . 0.0 110.607 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -60.19 -35.17 74.77 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.454 0.302 . . . . 0.0 111.065 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -72.35 58.47 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.218 0.607 . . . . 0.0 110.421 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.2 p . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 110.967 177.015 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 42.5 p -156.63 135.32 11.64 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 104.751 -2.315 . . . . 0.0 104.751 -169.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.1 mt -85.07 116.25 28.23 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -63.88 144.24 57.22 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.82 0.737 . . . . 0.0 109.767 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.21 -46.31 1.48 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 174.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -54.99 -52.65 62.43 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.385 0.674 . . . . 0.0 111.019 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -58.19 -38.92 77.66 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.026 0.531 . . . . 0.0 109.912 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.2 tp -65.37 -45.69 83.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.512 0.596 . . . . 0.0 111.551 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.282 20.3 pttp -62.28 -39.4 92.81 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.88 -1.137 . . . . 0.0 111.673 175.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.8 -50.35 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.346 0.521 . . . . 0.0 110.151 171.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -53.03 57.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.875 0.87 . . . . 0.0 110.309 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtm -57.28 -42.21 81.21 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.736 0.414 . . . . 0.0 111.421 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -56.15 18.01 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 172.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.79 -39.12 73.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.197 0.599 . . . . 0.0 112.003 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.1 mt -70.64 -6.79 39.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.53 1.132 . . . . 0.0 112.539 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.4 22.61 36.81 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.456 1.025 . . . . 0.0 112.774 175.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -76.19 -179.2 4.88 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.211 1.005 . . . . 0.0 109.916 174.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.36 102.87 36.04 Favored Pre-proline 0 N--CA 1.452 -0.359 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 169.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -59.96 69.8 0.07 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.021 3.147 . . . . 0.0 115.699 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.49 88.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -32.15 -49.33 0.19 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.0 2.12 . . . . 0.0 115.074 -173.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -60.98 -48.27 82.6 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.571 0.623 . . . . 0.0 111.144 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -68.53 -42.43 78.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.457 0.703 . . . . 0.0 109.577 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mm -52.72 -57.69 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.329 0.651 . . . . 0.0 109.336 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -54.68 -51.05 66.74 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.805 0.842 . . . . 0.0 110.475 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -54.16 -57.92 9.33 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.197 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.3 ttp -56.92 -53.04 62.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.494 0.317 . . . . 0.0 110.254 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.4 mt -50.19 -49.79 21.84 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.299 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.2 m -58.3 -48.39 80.64 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.372 0.533 . . . . 0.0 111.482 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -57.72 -45.07 86.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.424 0.29 . . . . 0.0 111.401 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.4 mm -71.69 -33.62 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 122.206 -0.308 . . . . 0.0 110.832 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -75.81 69.84 2.51 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.03 0.932 . . . . 0.0 110.163 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? . . . . . 0 N--CA 1.445 -0.704 0 C-N-CA 124.586 1.154 . . . . 0.0 110.875 173.712 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.846 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.5 p -106.63 167.71 9.67 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.9 mm -121.04 113.7 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.775 1.63 . . . . 0.0 106.804 173.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -71.56 159.32 34.66 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.402 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -50.94 -43.86 60.25 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.259 0.624 . . . . 0.0 112.03 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.91 -48.52 81.35 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.387 0.54 . . . . 0.0 110.722 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -60.11 -47.44 85.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.852 0.461 . . . . 0.0 109.931 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -56.88 -50.37 72.69 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.755 0.822 . . . . 0.0 110.456 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.64 -44.17 89.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.389 0.676 . . . . 0.0 109.88 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.0 m -56.97 -49.61 75.19 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.907 -0.496 . . . . 0.0 110.221 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 61.2 ttp -52.67 -50.94 62.25 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 C--O 1.224 -0.257 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -178.361 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.9 p . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -55.77 -36.75 67.69 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.745 -0.597 . . . . 0.0 110.519 169.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -68.95 -46.36 68.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.668 -0.645 . . . . 0.0 109.562 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.39 -43.06 88.37 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.457 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.37 -45.78 92.29 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.921 0.782 . . . . 0.0 111.166 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -54.36 -54.3 42.35 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.15 0.432 . . . . 0.0 110.232 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -54.25 -46.78 72.69 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.257 0.623 . . . . 0.0 111.054 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.0 mt -59.59 -45.97 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.307 0.643 . . . . 0.0 110.3 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -60.15 -45.94 91.37 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.653 -0.655 . . . . 0.0 110.879 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -57.19 -51.72 68.2 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.072 0.549 . . . . 0.0 110.323 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -49.39 72.03 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.84 0.456 . . . . 0.0 110.691 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -52.79 -57.17 11.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.48 0.712 . . . . 0.0 110.263 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -52.46 -50.56 62.41 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.241 1.016 . . . . 0.0 110.836 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.23 -54.71 43.73 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -59.86 -33.58 71.99 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.424 -0.172 . . . . 0.0 111.044 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -72.51 51.55 0.26 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.449 1.099 . . . . 0.0 110.796 172.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 CA--C 1.531 0.228 0 C-N-CA 124.934 1.294 . . . . 0.0 111.618 -176.964 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.12 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.7 p -155.48 120.55 4.84 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -173.02 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -78.95 122.19 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.67 145.32 48.97 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 174.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.99 -48.24 0.76 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.615 1.166 . . . . 0.0 113.052 172.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.75 -48.62 80.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.021 0.528 . . . . 0.0 111.111 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -59.99 -42.47 94.29 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.027 -0.421 . . . . 0.0 109.888 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -62.64 -40.86 98.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.947 -0.471 . . . . 0.0 110.534 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -60.23 -47.76 84.59 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.6 t -54.55 -48.97 69.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 CA-C-N 118.216 0.462 . . . . 0.0 110.2 173.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.75 -51.17 64.23 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.163 -0.336 . . . . 0.0 110.592 176.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.9 mtm -59.21 -42.09 90.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.377 0.671 . . . . 0.0 111.948 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -57.69 -49.41 76.6 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.516 0.598 . . . . 0.0 110.018 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.95 -39.15 77.39 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.947 -0.471 . . . . 0.0 111.63 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -72.37 -1.88 17.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.528 1.131 . . . . 0.0 112.337 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 27.12 72.11 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-N 119.054 0.843 . . . . 0.0 112.373 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -80.78 164.07 23.01 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -106.05 92.51 6.62 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 107.634 -1.246 . . . . 0.0 107.634 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -75.8 75.84 3.91 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.115 1.876 . . . . 0.0 112.227 -169.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.14 98.68 0.11 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.692 1.197 . . . . 0.0 110.128 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -31.71 -57.09 0.28 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.314 2.245 . . . . 0.0 113.867 -174.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -51.71 -49.88 61.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.234 0.614 . . . . 0.0 111.176 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -70.5 -41.75 72.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 mm -57.0 -46.77 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.141 0.576 . . . . 0.0 110.995 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -55.52 -51.54 66.66 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.297 0.499 . . . . 0.0 110.421 177.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -59.37 -51.42 69.98 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.291 -0.255 . . . . 0.0 110.695 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.8 ttp -50.0 -56.79 9.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.535 0.734 . . . . 0.0 109.974 177.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -50.65 -49.72 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 C-N-CA 123.526 0.73 . . . . 0.0 109.563 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 p -58.56 -47.02 85.63 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.479 0.581 . . . . 0.0 111.219 -178.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -60.56 -43.42 97.28 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.642 0.777 . . . . 0.0 110.903 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.5 mm -71.53 -34.15 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 O-C-N 122.218 -0.301 . . . . 0.0 110.766 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -78.47 67.31 4.22 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.586 -0.696 . . . . 0.0 110.559 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 125.921 1.688 . . . . 0.0 113.028 176.474 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.045 0 CA-C-O 120.046 -0.308 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.4 p -161.32 161.56 30.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -170.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.8 mm -99.88 110.09 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.18 158.07 36.47 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.578 0.751 . . . . 0.0 110.299 170.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.46 -47.74 38.1 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.707 0.803 . . . . 0.0 112.24 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.51 -40.73 95.65 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.356 0.525 . . . . 0.0 110.733 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -65.6 -45.93 81.29 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.32 -47.31 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.65 0.78 . . . . 0.0 111.1 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.1 tp -57.15 -49.02 77.26 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.527 0.731 . . . . 0.0 109.699 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 m -55.67 -48.76 74.5 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.573 0.349 . . . . 0.0 110.257 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 28.0 ttt -52.95 -54.1 39.95 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.868 0.867 . . . . 0.0 110.23 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 CA--C 1.533 0.324 0 O-C-N 122.056 -0.403 . . . . 0.0 111.087 176.679 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.0 p . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -59.46 -39.64 84.29 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 173.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -52.99 -55.22 25.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.765 1.226 . . . . 0.0 110.69 169.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -56.53 -49.13 75.68 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.447 -0.783 . . . . 0.0 110.702 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -59.11 -40.08 84.24 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.263 0.483 . . . . 0.0 111.616 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.78 -55.83 27.72 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.561 0.619 . . . . 0.0 110.6 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -53.76 -48.58 69.59 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.735 0.302 . . . . 0.0 110.847 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 86.1 mt -58.96 -47.54 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 123.915 0.886 . . . . 0.0 110.334 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -58.88 -51.78 68.55 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.145 0.578 . . . . 0.0 110.59 177.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -56.19 -51.54 67.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.054 0.542 . . . . 0.0 110.304 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.33 -51.03 69.75 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 110.814 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -50.18 -58.65 5.13 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.987 0.915 . . . . 0.0 109.706 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -52.81 -51.35 61.17 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.812 0.845 . . . . 0.0 110.252 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tt -56.18 -52.81 63.04 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.114 0.166 . . . . 0.0 111.055 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -60.17 -40.65 90.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.814 0.34 . . . . 0.0 110.706 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -77.28 40.21 0.27 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.651 1.18 . . . . 0.0 112.552 -171.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 125.761 1.624 . . . . 0.0 111.653 -174.913 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.59 0 N-CA-C 108.71 -1.756 . . . . 0.0 108.71 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.1 p -137.74 130.89 30.48 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.319 0.648 . . . . 0.0 109.684 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.9 mt -73.76 112.2 10.04 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.42 146.83 50.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.057 0.39 . . . . 0.0 110.037 172.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.91 -48.0 0.73 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.043 0.937 . . . . 0.0 113.067 172.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -58.78 -46.75 86.82 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.176 0.59 . . . . 0.0 111.441 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.94 -39.76 93.21 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.862 -0.523 . . . . 0.0 109.644 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.51 -43.21 99.37 Favored 'General case' 0 CA--C 1.532 0.262 0 O-C-N 121.82 -0.55 . . . . 0.0 110.518 174.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -58.2 -48.19 81.11 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.459 -0.775 . . . . 0.0 110.478 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.35 -48.47 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 122.183 -0.323 . . . . 0.0 110.294 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -50.39 66.62 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.678 0.391 . . . . 0.0 110.635 177.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.4 mtm -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.437 0.695 . . . . 0.0 111.359 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -57.37 -46.74 83.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.893 0.77 . . . . 0.0 111.087 171.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.41 -38.23 76.98 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.754 -0.591 . . . . 0.0 111.479 175.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.2 mt -73.16 0.01 12.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.471 1.108 . . . . 0.0 112.456 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.3 71.95 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.184 0.897 . . . . 0.0 113.021 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -76.78 160.37 29.35 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.042 0.921 . . . . 0.0 109.755 177.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -107.18 108.31 61.71 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 169.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -56.3 76.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.445 3.43 . . . . 0.0 115.201 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.7 mmmm -65.7 80.38 0.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.958 1.303 . . . . 0.0 108.855 169.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -31.86 -52.51 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.208 2.203 . . . . 0.0 115.07 -170.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -63.33 -45.37 91.59 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.519 -0.738 . . . . 0.0 111.379 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.76 -43.57 88.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.7 mm -55.76 -48.29 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.055 0.542 . . . . 0.0 109.897 174.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -49.79 76.46 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.799 -0.563 . . . . 0.0 110.87 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -54.91 -56.04 23.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.802 0.273 . . . . 0.0 110.532 177.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.6 ttt -47.7 -62.46 1.44 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.183 1.393 . . . . 0.0 110.187 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.72 -49.05 26.95 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 123.088 0.555 . . . . 0.0 109.62 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -58.61 -49.85 75.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.552 0.615 . . . . 0.0 111.601 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -56.81 -44.65 82.2 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.864 0.466 . . . . 0.0 111.042 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 mm -71.85 -34.58 51.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 O-C-N 122.325 -0.234 . . . . 0.0 111.011 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -76.86 73.24 3.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.776 0.83 . . . . 0.0 110.263 -175.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 123.522 0.729 . . . . 0.0 111.136 174.676 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -108.66 159.98 16.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.0 mm -116.99 108.79 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 126.193 1.797 . . . . 0.0 106.742 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -69.09 155.99 39.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.778 0.831 . . . . 0.0 110.139 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -46.33 -47.01 18.55 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.184 0.594 . . . . 0.0 112.155 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -58.48 -43.84 89.14 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.674 0.67 . . . . 0.0 110.779 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.12 -43.14 92.95 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -58.41 -49.0 78.83 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.406 0.622 . . . . 0.0 110.495 176.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.17 -42.47 86.08 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.305 0.642 . . . . 0.0 110.027 175.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 m -56.89 -47.5 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.525 0.602 . . . . 0.0 110.288 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.1 tmm? -55.38 -48.21 74.65 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.101 -0.374 . . . . 0.0 110.664 175.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.3 mmt . . . . . 0 CA--C 1.53 0.181 0 O-C-N 122.119 -0.363 . . . . 0.0 110.322 177.892 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 51.7 p . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 121.184 0.516 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -48.59 -41.2 30.03 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.351 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -53.01 -53.6 47.67 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.939 0.896 . . . . 0.0 110.14 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.55 -40.23 93.94 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.52 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -55.41 -46.24 76.63 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.522 0.601 . . . . 0.0 110.561 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -58.63 -50.79 72.55 Favored 'General case' 0 C--O 1.225 -0.19 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -53.76 -48.31 69.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.524 0.33 . . . . 0.0 111.243 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.13 -46.54 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.171 0.588 . . . . 0.0 109.676 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -61.34 -44.59 96.93 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.895 -0.503 . . . . 0.0 111.417 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -56.78 -50.46 72.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.706 -0.621 . . . . 0.0 110.006 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.31 69.16 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.466 0.306 . . . . 0.0 110.575 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -51.28 -57.66 8.26 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.453 0.701 . . . . 0.0 111.078 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -56.74 -46.95 81.05 Favored 'General case' 0 C--O 1.227 -0.095 0 C-N-CA 123.142 0.577 . . . . 0.0 110.674 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.1 tt -56.1 -52.81 62.98 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.497 0.319 . . . . 0.0 110.248 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -60.06 -40.43 89.46 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -72.56 59.97 0.46 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.709 0.404 . . . . 0.0 110.808 170.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.8 p . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 124.774 1.23 . . . . 0.0 111.275 176.103 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.225 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 79.0 p -151.77 149.52 29.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.366 2.266 . . . . 0.0 106.498 -171.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.7 mt -86.71 115.76 28.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.95 145.9 55.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.269 0.94 . . . . 0.0 110.651 174.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.6 -50.04 1.13 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.927 0.891 . . . . 0.0 113.069 173.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -54.36 -53.68 50.64 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.693 0.797 . . . . 0.0 110.655 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -58.71 -37.56 76.41 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.628 0.771 . . . . 0.0 110.412 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.1 tp -67.07 -46.61 73.78 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.885 -0.509 . . . . 0.0 110.876 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.283 21.1 pttp -63.65 -36.03 82.5 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.487 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.4 t -57.38 -48.57 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 118.286 0.494 . . . . 0.0 110.502 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.85 -50.66 65.74 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.834 -0.541 . . . . 0.0 110.003 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 19.0 mtm -57.12 -45.77 83.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.68 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -54.19 -50.56 66.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.863 0.756 . . . . 0.0 110.48 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.92 -40.25 75.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.123 -0.361 . . . . 0.0 111.219 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.5 mt -74.25 1.76 10.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.264 1.026 . . . . 0.0 112.798 175.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.95 20.17 65.9 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.181 0.901 . . . . 0.0 113.292 174.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -77.77 163.1 26.43 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.149 0.974 . . . . 0.0 109.506 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -109.02 108.18 60.44 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.79 76.11 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.597 3.531 . . . . 0.0 115.669 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.41 84.01 0.16 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -31.48 -57.87 0.26 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 127.426 2.291 . . . . 0.0 114.067 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.71 -44.74 81.87 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.675 -0.641 . . . . 0.0 111.634 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -71.0 -39.02 72.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.8 mm -54.02 -49.15 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 171.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -58.81 -49.75 76.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.963 -0.541 . . . . 0.0 111.386 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -52.32 -58.16 7.52 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.529 0.604 . . . . 0.0 110.103 177.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.7 ttt -49.03 -60.93 2.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.921 1.288 . . . . 0.0 110.16 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.7 mt -50.48 -49.05 25.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 122.967 0.507 . . . . 0.0 109.71 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.5 m -58.83 -49.27 78.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.333 0.515 . . . . 0.0 111.581 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.04 -45.04 83.48 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.715 0.234 . . . . 0.0 111.203 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.1 mm -72.0 -34.33 50.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 O-C-N 122.034 -0.416 . . . . 0.0 111.02 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -78.42 74.01 4.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.886 0.874 . . . . 0.0 110.404 -174.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 123.061 0.545 . . . . 0.0 111.133 173.589 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.837 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -112.04 161.42 16.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.8 mm -104.82 123.13 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 124.914 1.285 . . . . 0.0 107.65 173.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -74.79 161.15 29.86 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.756 0.823 . . . . 0.0 110.105 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.08 -46.81 84.83 Favored 'General case' 0 C--O 1.226 -0.155 0 O-C-N 121.955 -0.466 . . . . 0.0 111.573 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -57.91 -46.62 84.69 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.946 0.339 . . . . 0.0 110.951 178.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -58.73 -51.4 70.1 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.073 0.549 . . . . 0.0 109.985 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -54.74 -51.95 64.05 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.51 0.724 . . . . 0.0 110.822 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.58 -48.71 71.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.241 0.617 . . . . 0.0 109.908 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.3 m -56.61 -49.55 74.62 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.403 0.281 . . . . 0.0 110.532 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.6 ttp -54.82 -53.25 57.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.771 0.829 . . . . 0.0 110.62 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 92.5 mmm . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.137 0.575 . . . . 0.0 110.441 179.633 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 64.7 p . . . . . 0 CA--C 1.532 0.282 0 CA-C-O 121.034 0.445 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -54.1 -36.84 63.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.106 0.479 . . . . 0.0 110.286 171.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -61.94 -51.45 68.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.528 -0.732 . . . . 0.0 109.682 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -53.47 -47.3 69.91 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.143 0.428 . . . . 0.0 110.712 174.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -55.79 -48.06 76.02 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.554 0.616 . . . . 0.0 111.243 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -56.15 -51.25 68.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.778 0.431 . . . . 0.0 110.883 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -55.13 -51.14 67.38 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.261 0.624 . . . . 0.0 110.8 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.5 mt -58.76 -46.58 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.16 0.584 . . . . 0.0 109.725 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -59.39 -47.39 85.65 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.895 -0.503 . . . . 0.0 110.852 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.33 -53.17 60.52 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.086 0.554 . . . . 0.0 110.271 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.68 -48.94 71.79 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.646 0.378 . . . . 0.0 110.587 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -52.7 -57.62 9.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.936 0.895 . . . . 0.0 110.787 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -56.56 -47.88 78.53 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.413 0.685 . . . . 0.0 110.449 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.35 -53.21 59.05 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.76 0.254 . . . . 0.0 110.365 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -60.82 -38.47 85.52 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.987 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.75 61.9 0.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.62 0.645 . . . . 0.0 109.684 170.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.7 p . . . . . 0 CA--C 1.532 0.26 0 C-N-CA 124.768 1.227 . . . . 0.0 111.369 179.514 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.056 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.6 p -137.78 147.98 45.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.591 1.956 . . . . 0.0 107.562 -177.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -80.33 122.89 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.81 145.53 52.06 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.061 0.846 . . . . 0.0 110.086 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.18 -46.4 2.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.924 0.89 . . . . 0.0 113.146 175.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -60.72 -46.27 91.07 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.927 -0.483 . . . . 0.0 111.047 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -60.31 -38.9 85.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.8 tp -62.75 -43.4 98.91 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.814 -0.554 . . . . 0.0 110.257 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.2 -47.84 82.19 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.563 -0.711 . . . . 0.0 110.34 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.1 t -55.23 -49.23 74.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 122.246 -0.284 . . . . 0.0 110.325 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.59 -48.9 68.8 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.974 0.509 . . . . 0.0 110.695 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mtm -62.26 -41.4 98.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.295 0.638 . . . . 0.0 111.426 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -57.44 -46.08 83.98 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.807 0.731 . . . . 0.0 110.802 170.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.95 -38.44 79.06 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.597 0.635 . . . . 0.0 111.531 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.0 mt -71.6 -0.44 10.71 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.198 0.999 . . . . 0.0 112.378 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.8 18.87 74.36 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.231 0.92 . . . . 0.0 112.66 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -78.38 160.21 27.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.109 0.954 . . . . 0.0 109.623 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -108.21 107.26 60.02 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -54.95 75.26 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.991 3.794 . . . . 0.0 116.028 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -65.07 85.04 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.495 1.118 . . . . 0.0 108.522 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -31.43 -58.16 0.25 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 127.234 2.214 . . . . 0.0 113.878 -171.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -57.56 -46.15 84.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.707 -0.621 . . . . 0.0 112.12 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -66.08 -43.22 87.97 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.7 mm -54.06 -53.57 27.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 C-N-CA 123.224 0.61 . . . . 0.0 109.796 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -56.34 -52.04 66.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.188 0.595 . . . . 0.0 110.825 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.02 -58.08 8.66 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.64 -54.21 40.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.149 0.98 . . . . 0.0 110.534 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.9 mt -51.08 -50.82 23.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.46 -46.96 85.53 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.482 0.583 . . . . 0.0 111.712 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -57.68 -45.37 85.69 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.855 0.462 . . . . 0.0 110.995 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.24 -34.86 55.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.633 0.254 . . . . 0.0 110.608 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -78.87 76.6 5.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.78 0.832 . . . . 0.0 110.275 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt . . . . . 0 CA--C 1.535 0.386 0 C-N-CA 123.12 0.568 . . . . 0.0 110.313 172.018 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.971 0 CA-C-O 119.633 -0.537 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.8 p -102.69 175.21 5.57 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 170.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.0 mm -116.09 120.43 64.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 172.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.96 158.41 35.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.478 1.111 . . . . 0.0 110.542 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -48.99 -52.97 21.92 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.075 0.55 . . . . 0.0 111.77 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.8 -38.76 92.28 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 119.006 0.821 . . . . 0.0 111.252 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.5 -49.07 79.03 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.926 -0.483 . . . . 0.0 109.781 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.23 -45.73 83.62 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.578 0.751 . . . . 0.0 110.994 175.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.61 -50.37 68.23 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.773 1.229 . . . . 0.0 108.903 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.7 m -58.4 -48.74 79.68 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.068 0.547 . . . . 0.0 110.404 178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.29 -51.37 64.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.727 0.811 . . . . 0.0 110.187 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.1 mmt . . . . . 0 CA--C 1.529 0.152 0 O-C-N 122.288 -0.257 . . . . 0.0 110.68 175.073 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.439 -1.013 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -43.95 -49.24 8.57 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 123.877 0.871 . . . . 0.0 111.669 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -49.62 -49.77 45.61 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.269 0.628 . . . . 0.0 111.827 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -64.63 -42.89 95.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.76 -0.587 . . . . 0.0 109.981 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -59.91 -39.34 85.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.471 0.578 . . . . 0.0 111.557 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -59.47 -53.94 52.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.508 0.723 . . . . 0.0 109.711 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -53.89 -49.08 69.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 83.6 mt -57.57 -43.51 83.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.125 0.97 . . . . 0.0 109.965 177.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -63.25 -44.56 94.83 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.539 -0.725 . . . . 0.0 111.341 177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -56.67 -50.58 71.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.309 0.504 . . . . 0.0 110.145 175.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.12 -52.26 63.83 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 110.372 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.98 -54.13 16.94 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.879 0.872 . . . . 0.0 110.641 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.5 -51.53 66.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.472 0.709 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -52.8 -53.53 47.05 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.89 -38.16 81.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.887 0.475 . . . . 0.0 111.31 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -73.12 62.48 0.65 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.128 0.422 . . . . 0.0 110.268 174.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 p . . . . . 0 N--CA 1.455 -0.212 0 C-N-CA 123.973 0.909 . . . . 0.0 111.139 179.749 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.863 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.3 p -130.45 138.22 50.19 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.723 1.609 . . . . 0.0 107.546 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.0 mt -79.81 110.92 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.104 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -175.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -60.75 147.22 43.16 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.194 -0.316 . . . . 0.0 110.2 173.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.96 -48.07 1.54 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -59.42 -45.21 92.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.958 0.503 . . . . 0.0 111.29 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -62.22 -38.41 89.08 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.002 -0.436 . . . . 0.0 109.852 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.36 -40.09 93.14 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.653 -0.654 . . . . 0.0 110.91 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -58.45 -47.28 84.52 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.321 -0.862 . . . . 0.0 110.738 171.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.1 t -53.99 -49.11 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 118.433 0.561 . . . . 0.0 109.908 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.66 -56.0 18.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.023 0.529 . . . . 0.0 110.82 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 18.0 mtm -53.45 -49.59 67.07 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.042 0.537 . . . . 0.0 111.264 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.97 -48.04 81.15 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.62 95.51 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.84 0.856 . . . . 0.0 111.247 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.16 -30.76 69.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.579 0.752 . . . . 0.0 110.856 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.14 7.53 10.11 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.627 1.108 . . . . 0.0 112.854 171.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -72.14 167.31 20.54 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.29 1.045 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -105.31 87.16 1.91 Allowed Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.865 1.666 . . . . 0.0 108.706 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.87 73.92 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.543 2.162 . . . . 0.0 112.668 -172.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -64.0 115.25 4.73 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.541 0.737 . . . . 0.0 109.253 172.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -41.51 -47.96 3.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.606 1.562 . . . . 0.0 112.333 -174.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.09 -56.12 16.44 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.62 0.768 . . . . 0.0 110.639 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.07 -44.16 85.3 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.555 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 mm -54.41 -53.83 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.54 0.736 . . . . 0.0 110.4 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -54.8 -52.32 63.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.966 0.507 . . . . 0.0 110.414 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -55.24 -59.98 4.03 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 122.907 0.129 . . . . 0.0 110.693 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.3 ttp -53.89 -54.83 33.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.223 0.609 . . . . 0.0 110.568 -176.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.4 mt -55.45 -50.22 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.25 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -57.86 -44.16 86.41 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.359 0.982 . . . . 0.0 111.89 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.97 -47.32 81.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.67 0.214 . . . . 0.0 110.818 177.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 31.9 mm -74.75 -35.28 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 122.136 -0.352 . . . . 0.0 111.625 -177.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -80.03 46.41 0.8 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.308 1.443 . . . . 0.0 111.909 -169.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.449 -0.514 0 O-C-N 121.599 -0.688 . . . . 0.0 110.5 -173.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.002 0 CA-C-O 119.247 -0.752 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p -125.71 122.8 37.35 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.003 0.902 . . . . 0.0 112.022 -173.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.1 mm -75.32 106.45 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.82 158.72 34.95 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.324 0.583 . . . . 0.0 109.846 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -47.74 -40.12 19.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.013 0.925 . . . . 0.0 112.573 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.65 -47.26 79.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.449 1.022 . . . . 0.0 111.727 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.97 -48.12 80.9 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.521 -0.737 . . . . 0.0 110.136 174.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -55.71 -50.68 69.69 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.09 0.471 . . . . 0.0 110.632 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.2 tp -54.18 -49.1 70.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.864 1.665 . . . . 0.0 109.935 175.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.9 m -57.77 -51.31 70.07 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.893 -0.504 . . . . 0.0 110.527 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 59.8 ttp -55.31 -50.07 70.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.941 0.496 . . . . 0.0 109.869 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.292 0 C-N-CA 123.19 0.596 . . . . 0.0 110.32 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -53.96 -42.97 69.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 171.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -56.21 -49.13 74.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.915 0.486 . . . . 0.0 110.605 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -56.01 -48.97 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.704 0.684 . . . . 0.0 111.139 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -55.73 -44.18 77.3 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.287 0.494 . . . . 0.0 111.238 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -57.68 -52.87 63.67 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.777 0.831 . . . . 0.0 109.791 176.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -56.64 -47.06 80.57 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.983 -0.448 . . . . 0.0 111.314 178.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.59 -46.28 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.307 0.643 . . . . 0.0 109.731 176.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -61.84 -46.45 89.4 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.765 -0.584 . . . . 0.0 111.16 178.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -55.57 -51.44 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.865 -0.522 . . . . 0.0 110.32 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.88 67.75 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.978 0.511 . . . . 0.0 110.433 177.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -49.42 -62.58 1.47 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.126 0.571 . . . . 0.0 110.196 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -52.86 -46.2 67.74 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.472 0.709 . . . . 0.0 111.073 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 tt -56.68 -53.2 60.41 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.676 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -62.29 -37.8 86.89 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.267 0.485 . . . . 0.0 110.979 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -70.91 29.27 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.6 2.36 . . . . 0.0 113.307 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.1 p . . . . . 0 CA--C 1.532 0.257 0 C-N-CA 127.168 2.187 . . . . 0.0 112.051 -176.332 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.702 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.0 p -136.45 123.65 21.77 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.418 0.687 . . . . 0.0 109.327 -173.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -72.08 123.9 27.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.83 147.47 41.12 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.41 -49.04 0.7 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.806 1.242 . . . . 0.0 112.8 171.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -54.2 -54.86 34.07 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.059 0.944 . . . . 0.0 110.926 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -57.84 -41.66 82.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.077 0.551 . . . . 0.0 109.84 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 tp -63.78 -46.78 83.67 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.996 -0.44 . . . . 0.0 111.247 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.257 19.9 ptpt -64.2 -36.11 82.99 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.221 -0.924 . . . . 0.0 111.556 177.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.96 -48.42 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.68 0.673 . . . . 0.0 110.105 171.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.2 -54.48 42.86 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.869 0.467 . . . . 0.0 110.493 177.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.8 mtm -53.88 -45.94 71.21 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.953 0.501 . . . . 0.0 111.43 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.24 -49.3 76.48 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.922 -0.486 . . . . 0.0 110.062 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.38 -40.12 77.48 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.784 0.434 . . . . 0.0 111.093 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.98 2.43 5.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.186 0.995 . . . . 0.0 113.027 174.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.59 18.76 65.34 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.185 0.902 . . . . 0.0 113.229 173.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -75.89 167.28 22.16 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.321 1.061 . . . . 0.0 110.092 172.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -109.52 105.85 57.74 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 169.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -56.86 71.67 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 124.887 3.724 . . . . 0.0 115.912 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -68.36 85.34 0.27 Allowed 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 169.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -31.17 -54.39 0.22 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 127.599 2.359 . . . . 0.0 113.629 -173.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -59.73 -48.73 80.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.814 0.446 . . . . 0.0 110.276 -177.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -64.6 -43.34 94.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.323 0.649 . . . . 0.0 109.68 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 mm -54.04 -52.88 32.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 123.182 0.593 . . . . 0.0 109.904 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -57.94 -48.0 81.24 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.215 0.606 . . . . 0.0 110.812 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.31 -54.94 33.49 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 33.8 ttp -56.44 -52.61 64.02 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.352 0.661 . . . . 0.0 110.361 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.5 mt -48.39 -49.57 12.95 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 123.116 0.566 . . . . 0.0 109.646 176.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -59.11 -49.38 78.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.753 -0.165 . . . . 0.0 111.397 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -56.63 -44.31 81.12 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.898 0.317 . . . . 0.0 111.368 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.0 mm -71.52 -34.96 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.692 0.397 . . . . 0.0 110.572 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -79.24 67.95 5.1 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.694 -0.629 . . . . 0.0 110.872 -174.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm . . . . . 0 CA--C 1.538 0.483 0 C-N-CA 125.342 1.457 . . . . 0.0 113.705 176.949 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.015 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.0 p -157.03 161.95 39.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.6 mm -101.21 106.51 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -65.66 154.82 37.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.092 0.557 . . . . 0.0 109.857 169.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -43.73 -52.06 6.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.592 0.757 . . . . 0.0 112.857 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.43 -34.04 77.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.849 0.75 . . . . 0.0 111.297 -177.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -67.95 -42.43 80.96 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.467 -0.77 . . . . 0.0 109.408 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.16 -45.82 90.0 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.058 -0.401 . . . . 0.0 110.446 173.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.13 -47.8 71.49 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.354 1.062 . . . . 0.0 109.025 174.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.1 m -58.2 -49.41 77.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.934 0.494 . . . . 0.0 110.889 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -54.29 -52.71 60.59 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.86 -0.525 . . . . 0.0 110.171 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 123.188 0.595 . . . . 0.0 110.044 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 65.8 p . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.853 0.359 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -52.81 -41.86 64.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.913 0.485 . . . . 0.0 109.889 172.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -54.68 -53.59 52.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.147 0.579 . . . . 0.0 110.578 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -56.1 -45.63 79.38 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 122.04 -0.413 . . . . 0.0 110.851 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -55.8 -47.34 77.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.696 0.68 . . . . 0.0 111.112 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -56.19 -51.01 69.59 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.727 0.411 . . . . 0.0 110.277 176.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.7 -51.18 64.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.881 0.31 . . . . 0.0 110.776 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.22 -42.23 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 123.77 0.828 . . . . 0.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -58.98 -51.16 71.25 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.618 0.767 . . . . 0.0 110.167 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.15 -41.15 97.28 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.311 -0.868 . . . . 0.0 111.54 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.6 -51.76 66.06 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.016 -0.428 . . . . 0.0 110.162 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -50.66 -53.77 28.34 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.556 0.742 . . . . 0.0 110.754 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -52.68 -52.92 53.8 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.264 1.026 . . . . 0.0 110.242 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.84 -51.93 65.79 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.284 0.234 . . . . 0.0 110.854 178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -59.78 -39.41 84.8 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.419 -0.175 . . . . 0.0 110.545 -179.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.82 63.83 0.92 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.471 0.709 . . . . 0.0 109.924 172.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 77.5 p . . . . . 0 CA--C 1.536 0.441 0 C-N-CA 123.822 0.849 . . . . 0.0 111.331 171.14 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.084 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -150.06 121.27 7.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.025 1.33 . . . . 0.0 108.45 -169.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.0 mt -81.56 114.66 22.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.16 148.33 50.23 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.906 0.775 . . . . 0.0 110.307 171.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.88 -47.99 1.1 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.053 0.941 . . . . 0.0 113.142 173.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -58.92 -46.52 87.72 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.148 0.579 . . . . 0.0 111.228 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -61.82 -41.18 97.47 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.74 -45.25 93.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.599 0.636 . . . . 0.0 110.492 176.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -54.93 -50.18 69.48 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.702 -0.624 . . . . 0.0 110.233 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.33 -48.19 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.062 0.392 . . . . 0.0 110.542 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.72 -54.83 32.44 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.197 0.599 . . . . 0.0 110.458 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.6 mtm -56.03 -42.43 76.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.831 0.852 . . . . 0.0 110.992 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -60.56 -45.51 93.61 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.834 -0.541 . . . . 0.0 110.621 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.86 -37.99 84.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.533 0.733 . . . . 0.0 111.138 175.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.0 mt -68.22 -0.42 4.67 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.949 0.899 . . . . 0.0 112.121 171.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.5 13.94 66.82 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.786 1.184 . . . . 0.0 112.399 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -79.46 161.96 25.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.291 1.045 . . . . 0.0 109.825 -176.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -105.45 93.82 7.52 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -68.46 83.87 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.133 1.888 . . . . 0.0 112.353 -173.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -60.07 90.2 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.894 1.278 . . . . 0.0 110.041 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -31.37 -59.55 0.24 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 127.353 2.261 . . . . 0.0 114.051 -170.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.4 -47.68 83.1 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.641 0.655 . . . . 0.0 111.795 -176.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -65.8 -41.41 91.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.3 mm -56.69 -50.84 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 122.794 0.438 . . . . 0.0 110.285 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -60.08 -45.34 93.26 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.441 0.564 . . . . 0.0 111.155 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -53.93 -56.62 16.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.24 0.473 . . . . 0.0 110.282 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.9 ttp -54.42 -53.45 53.99 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.978 0.511 . . . . 0.0 110.81 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.5 mt -49.66 -49.54 19.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 123.512 0.725 . . . . 0.0 109.455 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -59.13 -46.22 88.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.342 0.519 . . . . 0.0 111.522 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.12 -42.95 86.9 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.648 0.379 . . . . 0.0 111.448 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.3 mm -74.79 -34.84 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 122.049 -0.407 . . . . 0.0 111.032 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -78.36 80.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.827 0.851 . . . . 0.0 110.63 -173.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 123.556 0.742 . . . . 0.0 110.878 174.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.841 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.3 p -110.49 176.55 5.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.321 0.648 . . . . 0.0 109.543 175.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.1 mm -114.79 114.96 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.986 1.714 . . . . 0.0 106.93 169.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.49 160.08 32.1 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.552 1.141 . . . . 0.0 110.534 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -52.73 -52.07 57.82 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.842 0.457 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.69 -44.72 90.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.322 0.51 . . . . 0.0 110.873 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -56.93 -51.01 70.84 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.82 -48.37 78.14 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.165 0.586 . . . . 0.0 111.287 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -58.83 -45.42 90.04 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 121.804 -0.56 . . . . 0.0 110.0 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.9 m -59.21 -52.24 66.53 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 122.083 -0.385 . . . . 0.0 110.292 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 21.2 ttt -49.21 -55.26 13.07 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.911 0.884 . . . . 0.0 109.982 175.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 44.0 tpp . . . . . 0 N--CA 1.451 -0.387 0 C-N-CA 123.538 0.735 . . . . 0.0 110.211 -178.766 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.452 -0.367 0 CA-C-O 120.974 0.416 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -50.2 -46.91 54.83 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.942 0.497 . . . . 0.0 110.105 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -43.45 -56.29 3.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.165 1.386 . . . . 0.0 111.701 170.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -65.17 -39.75 93.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 121.962 -0.461 . . . . 0.0 110.158 -177.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -60.76 -40.49 92.67 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.647 -0.658 . . . . 0.0 111.088 175.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -57.72 -51.52 69.19 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.787 -0.571 . . . . 0.0 109.838 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.19 -48.11 68.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.064 0.393 . . . . 0.0 111.208 177.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 87.0 mt -57.93 -46.15 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 123.769 0.828 . . . . 0.0 110.042 177.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -60.44 -46.24 90.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.712 0.687 . . . . 0.0 111.014 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -57.69 -52.1 66.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.778 0.431 . . . . 0.0 110.325 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -50.21 69.94 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.746 0.418 . . . . 0.0 110.513 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -51.48 -54.9 22.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.541 0.736 . . . . 0.0 110.722 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -55.22 -49.34 72.22 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.759 0.824 . . . . 0.0 110.562 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 tt -56.06 -52.48 64.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.666 0.212 . . . . 0.0 110.656 178.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -60.13 -42.6 95.16 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.597 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -74.56 64.67 1.21 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.893 0.877 . . . . 0.0 109.735 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 123.628 0.771 . . . . 0.0 111.923 174.675 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.279 0 CA-C-O 119.716 -0.491 . . . . 0.0 114.276 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.8 p -150.09 122.44 8.43 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.03 1.332 . . . . 0.0 109.086 -174.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -80.77 111.08 17.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -63.07 147.62 50.21 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.89 -46.81 1.35 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.507 1.123 . . . . 0.0 113.242 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.4 -48.14 82.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.959 0.504 . . . . 0.0 110.985 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -61.21 -41.52 97.0 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.43 -44.19 95.3 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.939 -0.476 . . . . 0.0 110.299 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -56.42 -49.21 75.2 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.664 -0.648 . . . . 0.0 110.482 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.9 t -54.32 -49.09 66.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.51 -56.46 16.8 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.868 0.467 . . . . 0.0 110.735 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 48.5 mtm -56.05 -44.02 78.44 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.497 0.719 . . . . 0.0 111.487 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -58.11 -51.5 69.45 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.43 78.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.342 0.657 . . . . 0.0 111.474 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -67.55 -10.89 56.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.456 1.103 . . . . 0.0 112.061 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.83 9.41 54.45 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.346 0.974 . . . . 0.0 113.242 172.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -74.15 165.35 25.31 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.7 1.25 . . . . 0.0 109.938 176.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -104.08 92.49 4.59 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.73 77.13 3.09 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 121.786 1.657 . . . . 0.0 112.384 -170.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -60.74 97.42 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.45 1.1 . . . . 0.0 110.124 173.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -31.76 -51.99 0.23 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.691 2.397 . . . . 0.0 113.903 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -58.47 -56.26 24.48 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.089 0.555 . . . . 0.0 111.441 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.71 -42.64 99.75 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.2 mm -58.25 -49.28 82.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 122.976 0.511 . . . . 0.0 110.638 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -57.63 -48.41 79.52 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.393 0.677 . . . . 0.0 109.911 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -53.73 -57.42 10.91 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -54.48 -54.01 46.63 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 110.885 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.5 mt -50.28 -47.26 25.72 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.3 0.64 . . . . 0.0 109.896 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.0 m -62.15 -42.31 99.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.086 0.403 . . . . 0.0 111.604 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.35 -47.11 86.67 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.4 0.546 . . . . 0.0 111.153 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.64 -34.71 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 122.204 -0.31 . . . . 0.0 110.947 -177.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -85.55 92.34 8.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.804 0.841 . . . . 0.0 110.104 -176.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.3 tptt . . . . . 0 CA--C 1.539 0.519 0 C-N-CA 124.686 1.195 . . . . 0.0 112.979 176.371 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.865 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.8 p -140.49 128.68 22.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.529 1.132 . . . . 0.0 109.496 -175.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.4 mm -95.24 108.76 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.67 159.48 34.36 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -51.28 -51.29 55.55 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 121.901 -0.499 . . . . 0.0 111.959 -178.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -53.72 -46.36 70.76 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.933 0.397 . . . . 0.0 111.029 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.48 -47.62 83.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.901 0.48 . . . . 0.0 109.864 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -54.97 -53.2 58.8 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.149 0.58 . . . . 0.0 110.47 176.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -55.18 -47.02 75.79 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.278 0.631 . . . . 0.0 110.001 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.5 m -57.51 -49.73 75.36 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.229 -0.294 . . . . 0.0 110.564 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 53.8 ttp -55.19 -52.75 62.34 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.214 0.606 . . . . 0.0 110.302 178.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 93.6 mmm . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 122.859 0.463 . . . . 0.0 110.134 177.501 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -47.43 -43.99 24.38 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.364 0.665 . . . . 0.0 111.081 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -56.37 -42.94 78.65 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 122.033 -0.417 . . . . 0.0 111.656 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -63.81 -45.36 89.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -55.08 -48.37 73.63 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.093 0.406 . . . . 0.0 110.602 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -55.64 -53.02 61.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.945 0.898 . . . . 0.0 110.139 177.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -53.33 -47.6 69.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 110.945 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.13 -41.86 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.906 -0.496 . . . . 0.0 110.356 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -45.6 92.05 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.562 -0.711 . . . . 0.0 110.172 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -55.87 -52.75 62.98 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.359 -0.838 . . . . 0.0 110.44 176.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.65 -50.47 68.08 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.254 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -50.02 -55.7 13.68 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.322 0.649 . . . . 0.0 110.442 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -54.49 -51.52 64.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 110.629 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.2 -52.09 66.73 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.452 0.168 . . . . 0.0 110.938 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.01 -30.87 71.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.308 -0.245 . . . . 0.0 111.407 -178.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -76.31 47.18 0.45 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.833 1.253 . . . . 0.0 109.586 173.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.395 0 C-N-CA 125.646 1.579 . . . . 0.0 111.626 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.569 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -141.96 135.39 29.32 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.44 0.696 . . . . 0.0 109.877 -172.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 81.2 mt -74.35 112.49 11.47 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.081 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -176.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.26 146.13 48.94 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.566 0.621 . . . . 0.0 109.952 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.17 -47.77 1.19 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.758 0.823 . . . . 0.0 112.803 172.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.61 -45.36 89.36 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 111.376 177.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.1 -38.93 93.13 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.964 -0.46 . . . . 0.0 110.032 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.49 -40.23 92.83 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.725 -0.61 . . . . 0.0 110.502 176.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 tmmm? -57.29 -49.07 77.24 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.481 -0.762 . . . . 0.0 110.562 172.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.1 -50.03 47.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 118.62 0.646 . . . . 0.0 110.385 173.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.31 -55.11 27.34 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.525 0.73 . . . . 0.0 110.602 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 68.7 mtm -56.66 -41.4 77.16 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.337 0.655 . . . . 0.0 111.126 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.94 49.94 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 174.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.25 -40.2 81.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.556 0.742 . . . . 0.0 111.447 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.5 mt -68.16 -3.66 11.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.168 0.987 . . . . 0.0 112.312 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.58 24.25 56.62 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 119.372 0.987 . . . . 0.0 112.317 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.24 172.86 11.05 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -118.22 101.52 51.3 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -55.35 73.34 0.03 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 124.578 3.518 . . . . 0.0 116.704 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -68.99 90.73 0.45 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 169.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -31.61 -49.08 0.16 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.327 2.251 . . . . 0.0 113.197 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.41 -58.66 6.34 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.807 0.843 . . . . 0.0 110.758 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -67.16 -42.86 83.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.786 0.834 . . . . 0.0 109.696 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 12.3 mm -52.2 -56.11 7.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 123.568 0.747 . . . . 0.0 109.652 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.67 -51.36 69.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.342 0.657 . . . . 0.0 110.694 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -53.7 -57.19 11.74 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.806 0.275 . . . . 0.0 110.44 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.93 -53.71 52.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.581 0.752 . . . . 0.0 110.551 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 51.7 mt -50.32 -49.6 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 110.154 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -59.65 -47.28 86.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.031 0.378 . . . . 0.0 111.153 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -57.31 -44.73 84.39 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.6 0.36 . . . . 0.0 111.11 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -71.33 -34.08 52.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 O-C-N 122.196 -0.315 . . . . 0.0 110.885 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -73.63 72.51 1.45 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.028 0.931 . . . . 0.0 110.679 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 123.16 0.584 . . . . 0.0 111.066 173.884 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.86 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -105.43 163.64 12.48 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 117.306 0.553 . . . . 0.0 109.527 169.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.4 mm -120.37 115.31 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.101 1.761 . . . . 0.0 106.709 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -73.51 160.86 31.08 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.315 1.046 . . . . 0.0 110.512 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -49.31 -45.0 44.71 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.328 0.651 . . . . 0.0 111.97 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.5 -46.79 88.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.954 0.797 . . . . 0.0 110.927 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -61.64 -46.8 88.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.92 0.488 . . . . 0.0 109.733 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.06 -48.99 79.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.095 0.558 . . . . 0.0 110.637 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.31 -45.19 76.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.928 0.891 . . . . 0.0 109.918 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.0 m -57.26 -51.67 68.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.873 0.306 . . . . 0.0 110.274 175.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -53.56 -52.13 60.71 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.61 0.364 . . . . 0.0 110.711 177.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.7 mmm . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 123.088 0.555 . . . . 0.0 111.014 -179.22 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.4 p . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -53.44 -34.92 59.7 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.078 0.551 . . . . 0.0 110.971 170.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -64.26 -51.47 63.4 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.226 -0.921 . . . . 0.0 109.857 176.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -55.3 -45.96 76.24 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.278 -0.264 . . . . 0.0 110.416 175.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.42 -39.61 88.04 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.519 -0.738 . . . . 0.0 111.746 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -58.82 -47.76 83.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.16 0.891 . . . . 0.0 111.025 171.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -57.3 -47.3 81.85 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.998 -0.439 . . . . 0.0 110.657 177.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.51 -43.37 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.029 0.931 . . . . 0.0 109.926 178.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -56.8 -51.92 67.06 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.571 0.623 . . . . 0.0 110.323 172.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -53.85 -53.15 56.47 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.649 0.658 . . . . 0.0 110.876 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -50.84 68.68 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.89 0.476 . . . . 0.0 110.654 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -52.64 -53.21 50.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.895 0.878 . . . . 0.0 110.331 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.0 -51.34 68.09 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.443 1.097 . . . . 0.0 110.526 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.38 -51.75 68.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.441 0.162 . . . . 0.0 110.661 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.18 -37.71 81.04 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.823 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -74.59 57.88 0.76 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.663 0.744 . . . . 0.0 109.156 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.41 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -178.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.15 0 N-CA-C 112.073 -0.411 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.3 p -154.46 134.84 13.34 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.808 -1.923 . . . . 0.0 105.808 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -85.99 105.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 169.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.22 149.35 41.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.07 -48.62 1.23 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.867 1.267 . . . . 0.0 112.881 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -57.86 -48.15 80.64 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.844 0.458 . . . . 0.0 111.033 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.77 -39.24 93.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.878 0.471 . . . . 0.0 110.128 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 tp -63.44 -41.91 98.66 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.818 -0.551 . . . . 0.0 109.869 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -59.37 -47.87 83.78 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.749 -0.594 . . . . 0.0 110.452 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.8 t -51.94 -52.02 25.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.489 0.586 . . . . 0.0 110.153 173.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.38 -53.12 55.68 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 123.246 0.619 . . . . 0.0 110.765 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.43 -40.05 85.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.443 0.697 . . . . 0.0 111.54 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.26 -51.65 68.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 172.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.96 -38.11 75.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.848 -0.533 . . . . 0.0 111.841 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -71.58 -1.58 14.03 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.419 1.088 . . . . 0.0 112.183 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 73.12 29.82 64.01 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 119.032 0.833 . . . . 0.0 112.009 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -81.55 169.73 16.73 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 117.586 0.693 . . . . 0.0 109.158 173.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 mp0 -110.54 103.42 54.19 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.808 1.243 . . . . 0.0 107.76 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -57.36 74.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.308 3.338 . . . . 0.0 115.874 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -66.15 85.26 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 169.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -31.45 -55.5 0.26 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.048 2.139 . . . . 0.0 114.031 -172.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.2 -49.1 79.13 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.883 -0.51 . . . . 0.0 111.368 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -62.86 -43.68 98.14 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.306 0.642 . . . . 0.0 109.505 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.2 mm -55.44 -53.47 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.46 0.704 . . . . 0.0 109.863 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.8 -50.93 69.15 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.556 0.342 . . . . 0.0 110.951 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -53.67 -55.5 25.47 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.39 -54.19 43.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.569 0.748 . . . . 0.0 110.732 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.8 mt -51.44 -47.29 35.75 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 -48.1 82.97 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.042 0.383 . . . . 0.0 111.298 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.26 -42.73 77.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.67 0.388 . . . . 0.0 111.178 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.8 mm -76.7 -35.17 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-N 118.068 0.395 . . . . 0.0 111.636 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -85.12 92.78 8.47 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.663 -0.648 . . . . 0.0 111.004 -171.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.897 1.279 . . . . 0.0 113.571 177.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.039 0 CA-C-O 119.4 -0.667 . . . . 0.0 114.45 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.2 p -142.33 136.06 29.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.062 0.931 . . . . 0.0 109.589 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.4 mm -102.16 112.38 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -71.5 158.11 36.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.32 0.648 . . . . 0.0 109.924 170.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.54 -48.65 48.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.559 0.743 . . . . 0.0 112.398 177.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.7 -42.83 89.51 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.25 -0.281 . . . . 0.0 110.266 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -64.82 -46.11 83.36 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.839 0.456 . . . . 0.0 110.118 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.86 -52.71 61.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.921 0.888 . . . . 0.0 110.291 176.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.16 -48.0 79.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.172 0.589 . . . . 0.0 110.028 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.9 m -57.64 -46.54 84.03 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.805 -0.559 . . . . 0.0 110.793 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 55.6 ttp -53.16 -42.98 66.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.672 0.789 . . . . 0.0 110.465 177.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 177.016 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 38.3 p . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.0 mp0 -55.62 -35.81 66.27 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.012 -0.43 . . . . 0.0 109.961 170.074 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -68.86 -45.09 71.95 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.537 -0.727 . . . . 0.0 109.969 -179.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.24 -49.74 71.23 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.336 0.516 . . . . 0.0 110.135 171.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -57.79 -47.36 82.78 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.908 -0.495 . . . . 0.0 110.898 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.04 -59.5 4.46 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.278 0.631 . . . . 0.0 110.445 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -48.13 -50.55 28.27 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.924 0.89 . . . . 0.0 111.098 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.86 -45.06 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 122.745 0.418 . . . . 0.0 110.2 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -45.91 90.41 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.779 0.718 . . . . 0.0 110.908 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -49.68 76.77 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.545 -0.722 . . . . 0.0 110.469 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.05 -48.1 73.91 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.989 0.423 . . . . 0.0 110.23 176.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -53.33 -53.33 52.57 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.512 0.725 . . . . 0.0 110.651 176.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -54.54 -50.76 67.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.439 1.096 . . . . 0.0 110.078 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.26 -53.02 62.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -61.15 -37.05 81.49 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.065 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -74.41 60.66 0.87 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.41 0.684 . . . . 0.0 109.925 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 76.4 p . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 124.202 1.001 . . . . 0.0 110.819 173.507 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.006 0 N-CA-C 111.926 -0.469 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.9 p -158.76 136.63 10.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.032 -1.84 . . . . 0.0 106.032 -169.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 88.4 mt -88.12 114.98 27.58 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 174.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -62.88 146.15 53.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.644 1.111 . . . . 0.0 109.777 173.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.95 -45.48 1.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.04 0.836 . . . . 0.0 113.022 173.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.46 -46.62 88.25 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.821 -0.549 . . . . 0.0 111.165 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.01 -38.59 86.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.934 -0.479 . . . . 0.0 110.13 176.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.14 -43.2 99.35 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.809 -0.557 . . . . 0.0 110.277 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -58.54 -46.22 87.29 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.563 -0.71 . . . . 0.0 110.644 176.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.33 -45.86 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 O-C-N 122.051 -0.406 . . . . 0.0 110.498 173.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.14 -52.55 62.92 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.775 -0.578 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.02 -42.2 89.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.54 0.736 . . . . 0.0 111.347 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -55.31 -49.76 71.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.866 -0.521 . . . . 0.0 110.335 172.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.8 -38.72 86.31 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.142 0.577 . . . . 0.0 111.34 178.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 mt -68.87 -2.47 9.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.292 1.037 . . . . 0.0 112.052 173.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.4 25.49 70.36 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 119.019 0.827 . . . . 0.0 111.978 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.67 165.55 21.9 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -107.11 106.95 59.69 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 169.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -58.87 73.66 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.865 3.044 . . . . 0.0 115.096 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.96 96.3 0.59 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.492 -0.755 . . . . 0.0 109.013 173.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -31.2 -60.31 0.21 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 127.543 2.337 . . . . 0.0 114.081 -172.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -58.02 -54.76 43.25 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.09 -41.76 93.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.695 0.798 . . . . 0.0 110.447 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.8 mm -56.33 -55.61 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.135 0.574 . . . . 0.0 109.938 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -57.7 -46.02 84.91 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 122.379 -0.2 . . . . 0.0 110.84 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -55.19 -57.84 10.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.819 0.448 . . . . 0.0 109.903 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.4 ttp -54.41 -53.6 51.98 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.296 0.638 . . . . 0.0 110.233 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.33 -50.29 28.16 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.59 -44.09 89.72 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.819 0.736 . . . . 0.0 111.913 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -59.52 -39.97 85.62 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.953 -0.467 . . . . 0.0 111.386 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -80.72 -34.56 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 118.136 0.425 . . . . 0.0 111.743 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -85.86 87.61 7.44 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.163 0.985 . . . . 0.0 110.903 -169.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? . . . . . 0 CA--C 1.533 0.304 0 C-N-CA 123.889 0.876 . . . . 0.0 110.586 174.779 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.004 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.6 p -108.03 -179.88 4.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 169.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.7 mm -122.14 119.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -74.96 158.83 32.63 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.087 0.955 . . . . 0.0 110.208 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -50.82 -47.57 60.04 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.614 0.366 . . . . 0.0 111.703 178.049 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.09 -45.29 87.44 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.128 0.49 . . . . 0.0 110.535 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -62.77 -46.49 87.76 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.976 0.51 . . . . 0.0 110.017 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -58.37 -48.71 79.72 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.94 0.496 . . . . 0.0 110.671 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.61 -49.05 73.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.691 0.796 . . . . 0.0 109.743 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.9 m -55.98 -49.74 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 117.957 0.344 . . . . 0.0 110.499 178.012 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.4 ttp -54.32 -53.86 48.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.01 0.524 . . . . 0.0 110.498 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.1 mmt . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 110.523 -0.177 . . . . 0.0 110.523 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 121.03 0.443 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -54.44 -42.12 70.22 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 172.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -52.67 -55.3 23.54 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.797 0.839 . . . . 0.0 109.858 175.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -53.86 -50.49 66.15 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 119.117 -0.468 . . . . 0.0 110.843 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.86 -47.61 73.98 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.738 0.699 . . . . 0.0 111.268 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -57.95 -50.32 73.76 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.008 0.523 . . . . 0.0 110.855 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -58.5 -47.28 84.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.111 0.414 . . . . 0.0 111.118 178.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.77 -41.59 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -62.41 -47.48 83.92 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.64 -0.663 . . . . 0.0 110.948 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -53.97 -53.47 52.35 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.91 -49.25 69.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.99 0.516 . . . . 0.0 110.466 177.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -52.49 -57.64 9.27 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.354 0.662 . . . . 0.0 110.994 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -56.86 -47.53 80.2 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.943 0.497 . . . . 0.0 110.402 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.8 tt -54.92 -53.74 51.61 Favored 'General case' 0 C--N 1.338 0.074 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -60.01 -37.78 80.75 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.172 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -73.75 61.88 0.78 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.703 0.683 . . . . 0.0 109.601 169.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 57.0 p . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.664 1.186 . . . . 0.0 111.158 -179.794 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.027 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -130.76 147.04 52.37 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.914 2.086 . . . . 0.0 108.26 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.92 119.95 27.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.46 144.6 57.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.581 1.082 . . . . 0.0 110.1 173.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.03 -48.79 1.23 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -62.5 -43.51 98.65 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.722 -0.611 . . . . 0.0 110.945 179.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -60.17 -40.32 89.5 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.944 -0.473 . . . . 0.0 109.979 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -63.06 -43.91 97.29 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.786 -0.571 . . . . 0.0 110.223 175.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -57.48 -48.51 79.02 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.479 -0.763 . . . . 0.0 110.744 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.6 t -53.68 -50.58 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.781 0.433 . . . . 0.0 110.327 172.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.58 -53.19 49.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.117 0.567 . . . . 0.0 110.543 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 69.7 mtm -60.18 -42.71 95.58 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.356 0.662 . . . . 0.0 111.188 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -58.38 6.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.14 82.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.908 0.883 . . . . 0.0 112.19 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.94 -16.5 59.47 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.723 1.209 . . . . 0.0 111.76 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.32 24.47 12.49 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 118.637 0.653 . . . . 0.0 112.334 175.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -80.57 176.79 9.48 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -115.39 97.81 49.25 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -60.98 66.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.249 3.299 . . . . 0.0 116.684 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.64 104.99 1.13 Allowed 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.35 -0.844 . . . . 0.0 109.071 171.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -42.49 -46.83 4.94 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.525 1.53 . . . . 0.0 114.139 -170.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -59.72 -57.56 12.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.29 0.496 . . . . 0.0 110.37 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -58.32 -44.97 88.89 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.712 0.805 . . . . 0.0 109.929 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -53.43 -57.83 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.569 0.747 . . . . 0.0 110.18 175.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -57.72 -47.3 82.79 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.067 0.394 . . . . 0.0 111.097 -178.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -55.12 -58.2 8.65 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 52.7 ttp -56.1 -52.24 65.03 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.842 0.457 . . . . 0.0 110.567 -178.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 39.3 mt -49.79 -51.18 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.1 m -57.53 -49.72 75.42 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.173 0.442 . . . . 0.0 111.477 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -56.88 -43.53 81.37 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 117.838 0.29 . . . . 0.0 111.467 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 mm -71.59 -34.78 53.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 122.01 -0.431 . . . . 0.0 110.673 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -78.9 71.4 5.36 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.481 0.713 . . . . 0.0 111.682 -169.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 123.303 0.641 . . . . 0.0 111.845 176.021 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.887 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -102.78 175.94 5.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.9 mm -128.33 118.44 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 175.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -77.36 170.01 17.3 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.5 0.667 . . . . 0.0 111.221 177.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.44 -36.25 73.37 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.624 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -69.43 -50.17 48.25 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.439 0.563 . . . . 0.0 109.706 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -54.11 -50.2 67.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.914 0.886 . . . . 0.0 109.92 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -56.53 -54.85 41.09 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.958 0.503 . . . . 0.0 110.747 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.08 -47.24 68.69 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.601 0.76 . . . . 0.0 110.128 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 m -56.23 -52.05 65.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.619 0.368 . . . . 0.0 110.343 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 47.5 ttp -55.2 -56.82 15.64 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.0 mmm . . . . . 0 N--CA 1.455 -0.2 0 C-N-CA 122.869 0.468 . . . . 0.0 110.28 -177.576 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 p . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.902 0.382 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -57.55 -41.49 81.07 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 121.688 -0.632 . . . . 0.0 109.666 169.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.6 mp0 -55.18 -52.87 61.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.518 0.727 . . . . 0.0 109.973 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -55.41 -51.1 67.98 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.921 -0.487 . . . . 0.0 111.141 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.33 -41.93 90.25 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.711 0.687 . . . . 0.0 111.646 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -57.89 -53.63 56.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.114 1.366 . . . . 0.0 110.072 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -53.75 -48.7 69.44 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.234 0.614 . . . . 0.0 110.59 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.4 mt -60.35 -42.07 89.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 122.828 0.451 . . . . 0.0 110.276 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -61.35 -45.63 93.58 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.593 0.633 . . . . 0.0 110.851 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -58.04 -50.72 72.45 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.47 0.577 . . . . 0.0 110.672 177.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.55 -52.54 61.75 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -48.08 -60.15 2.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.532 0.733 . . . . 0.0 109.877 175.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -51.31 -49.18 61.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.321 1.048 . . . . 0.0 110.825 -177.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.86 -52.64 64.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.703 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -61.51 -36.37 80.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.172 0.442 . . . . 0.0 111.506 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -72.74 31.68 0.06 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.313 2.245 . . . . 0.0 113.071 -173.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.2 p . . . . . 0 CA--C 1.528 0.127 0 C-N-CA 127.512 2.325 . . . . 0.0 111.796 -173.39 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.707 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 p -135.69 120.96 19.04 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 117.788 0.794 . . . . 0.0 110.239 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.7 mt -72.89 114.12 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.18 147.38 51.07 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.203 0.456 . . . . 0.0 110.216 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.47 -47.85 0.92 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.053 0.941 . . . . 0.0 113.178 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -58.36 -49.26 77.84 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.927 0.491 . . . . 0.0 111.168 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -59.08 -42.75 91.18 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.29 -42.34 99.27 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.966 -0.458 . . . . 0.0 110.902 177.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.02 -47.91 83.9 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.335 -0.853 . . . . 0.0 110.445 176.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.4 t -54.62 -48.62 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 173.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -53.27 55.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.862 0.465 . . . . 0.0 110.584 177.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mtm -57.95 -42.65 85.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.271 0.628 . . . . 0.0 111.599 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -56.57 -52.07 66.2 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.512 0.596 . . . . 0.0 110.116 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.49 75.57 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 122.093 -0.38 . . . . 0.0 111.64 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -72.28 -2.49 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.863 1.265 . . . . 0.0 112.355 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.49 20.94 61.07 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 119.235 0.925 . . . . 0.0 113.362 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -83.36 159.68 21.8 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.259 1.029 . . . . 0.0 109.763 171.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -104.43 98.75 15.2 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 169.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.36 80.47 1.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.357 2.038 . . . . 0.0 112.15 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -59.79 90.54 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.213 1.405 . . . . 0.0 109.518 170.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -32.39 -51.7 0.27 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.058 2.143 . . . . 0.0 115.207 -171.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -60.15 -51.31 70.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.822 0.737 . . . . 0.0 110.535 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -62.79 -41.11 99.13 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.0 mm -59.16 -47.86 88.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.936 0.494 . . . . 0.0 110.562 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.67 -48.17 81.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.852 0.751 . . . . 0.0 110.453 177.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -54.7 -58.06 9.01 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -48.35 -59.61 3.32 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.421 1.488 . . . . 0.0 110.713 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.7 mt -51.38 -49.27 32.2 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 C-N-CA 123.472 0.709 . . . . 0.0 109.907 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.2 m -60.06 -47.1 87.28 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.582 0.628 . . . . 0.0 111.592 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.8 -45.49 85.99 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.483 0.313 . . . . 0.0 110.885 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.0 mm -71.65 -35.6 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 111.168 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -82.2 75.25 9.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.54 -0.725 . . . . 0.0 110.507 -170.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp . . . . . 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 0.0 113.11 172.857 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.133 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p -136.1 150.01 48.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.93 0.892 . . . . 0.0 108.931 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.3 mm -109.11 110.24 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 125.006 1.322 . . . . 0.0 108.102 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.21 152.09 45.58 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 171.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.7 -44.77 13.81 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -59.5 -46.8 87.8 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.489 0.586 . . . . 0.0 110.921 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -62.84 -45.95 90.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.019 0.528 . . . . 0.0 109.731 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -56.48 -50.81 70.65 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 123.7 0.8 . . . . 0.0 110.628 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.98 -46.91 84.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.723 0.809 . . . . 0.0 109.709 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.1 m -56.54 -53.7 54.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 117.832 0.287 . . . . 0.0 110.346 177.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -51.33 -53.96 31.0 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.095 0.958 . . . . 0.0 110.053 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 N--CA 1.449 -0.523 0 C-N-CA 123.024 0.53 . . . . 0.0 110.411 -176.421 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -56.06 -37.82 69.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.418 -0.801 . . . . 0.0 110.654 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -56.41 -53.66 54.82 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.169 0.588 . . . . 0.0 110.415 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -55.65 -44.87 77.59 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 175.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -53.59 -43.72 68.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.875 0.47 . . . . 0.0 111.243 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -58.26 -53.23 60.61 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -55.26 -44.35 75.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.543 0.211 . . . . 0.0 111.22 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.47 -45.31 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.016 0.926 . . . . 0.0 109.8 178.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -57.45 -52.47 65.24 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.283 0.492 . . . . 0.0 110.604 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -54.45 -50.84 66.75 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.483 -0.761 . . . . 0.0 111.221 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.8 72.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.195 0.598 . . . . 0.0 110.559 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -52.41 -53.68 41.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.704 0.801 . . . . 0.0 110.311 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -56.49 -50.65 71.16 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.254 0.621 . . . . 0.0 110.211 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.1 tt -57.18 -52.23 66.16 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -60.45 -39.07 86.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.113 0.165 . . . . 0.0 110.595 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -74.25 58.14 0.7 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 C-N-CA 124.343 1.057 . . . . 0.0 110.684 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.125 0 N-CA-C 112.427 -0.269 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.1 p -158.18 143.65 16.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 -169.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.7 mt -87.89 110.81 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.07 147.28 44.33 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.459 1.027 . . . . 0.0 110.324 175.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.43 -48.54 1.96 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.907 0.776 . . . . 0.0 113.037 173.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -59.3 -45.93 89.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.836 0.454 . . . . 0.0 110.996 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.22 -36.59 82.44 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.992 -0.442 . . . . 0.0 110.517 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.89 -41.89 90.97 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.651 -0.655 . . . . 0.0 110.069 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -57.89 -49.45 76.67 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.738 -0.601 . . . . 0.0 110.294 173.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 38.5 t -51.98 -51.37 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.066 0.394 . . . . 0.0 110.16 173.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -55.9 21.97 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.721 0.808 . . . . 0.0 110.743 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.6 mtm -54.84 -45.72 74.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.36 0.664 . . . . 0.0 110.99 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -58.22 -48.01 81.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.756 -0.59 . . . . 0.0 110.444 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.16 79.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.978 0.511 . . . . 0.0 111.35 176.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -70.1 -0.47 7.77 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.532 1.133 . . . . 0.0 112.222 174.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.81 16.76 62.87 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-N 119.117 0.872 . . . . 0.0 112.771 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -75.93 162.05 28.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.267 1.033 . . . . 0.0 109.436 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -108.19 105.77 57.21 Favored Pre-proline 0 N--CA 1.449 -0.506 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -56.13 78.5 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.312 3.341 . . . . 0.0 115.253 -178.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.35 81.37 0.09 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.161 0.984 . . . . 0.0 108.933 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -31.72 -56.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 127.329 2.252 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.98 -50.89 67.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.971 0.415 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.65 -40.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.07 0.548 . . . . 0.0 109.692 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.1 mm -53.64 -54.78 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -56.09 -52.67 63.46 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.673 0.789 . . . . 0.0 109.775 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -52.44 -57.86 8.54 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.897 0.479 . . . . 0.0 110.308 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -51.76 -54.46 28.34 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.8 0.84 . . . . 0.0 110.582 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.4 mt -51.61 -49.67 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -57.06 -48.1 79.37 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.056 0.389 . . . . 0.0 111.419 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -58.96 -42.35 89.68 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.94 0.337 . . . . 0.0 111.094 178.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.06 -31.32 44.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 O-C-N 122.156 -0.34 . . . . 0.0 111.231 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.37 75.74 0.54 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.855 0.862 . . . . 0.0 111.635 -173.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? . . . . . 0 N--CA 1.447 -0.58 0 C-N-CA 125.907 1.683 . . . . 0.0 109.848 171.152 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.194 0 CA-C-O 119.462 -0.632 . . . . 0.0 113.252 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 p -113.99 171.8 7.38 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.138 0.969 . . . . 0.0 108.815 169.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.6 mm -112.05 116.22 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 169.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.96 156.54 39.49 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.429 0.692 . . . . 0.0 109.783 174.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -51.99 -43.45 63.62 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.904 -0.497 . . . . 0.0 111.728 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -57.45 -46.38 83.68 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.354 0.524 . . . . 0.0 110.66 178.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.15 -47.42 82.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.753 0.421 . . . . 0.0 110.113 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -57.02 -51.71 68.16 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.691 0.758 . . . . 0.0 110.304 178.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.2 tp -52.87 -46.27 67.8 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.957 0.903 . . . . 0.0 110.044 174.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 59.2 m -58.3 -47.85 82.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.319 0.509 . . . . 0.0 111.192 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 77.5 mtp -53.26 -51.29 62.71 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.695 0.679 . . . . 0.0 109.827 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.862 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 29.3 m -75.8 129.41 37.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 159.81 154.63 7.37 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.8 mt -121.8 94.37 4.29 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.475 1.51 . . . . 0.0 109.895 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 158.4 26.43 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 171.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -45.37 -45.51 12.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.907 0.883 . . . . 0.0 111.863 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -55.95 -47.44 77.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.908 0.483 . . . . 0.0 110.834 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -61.99 -43.97 97.71 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.24 -44.11 92.35 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.233 -0.292 . . . . 0.0 110.849 178.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -57.86 -51.78 68.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.209 0.604 . . . . 0.0 110.006 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -52.96 -50.23 64.51 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.128 0.422 . . . . 0.0 111.058 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.76 -46.09 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 124.023 0.929 . . . . 0.0 110.377 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -61.17 -49.18 78.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.796 -0.565 . . . . 0.0 111.067 177.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -55.83 -52.27 64.58 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.568 -0.708 . . . . 0.0 110.569 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.82 75.25 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.389 0.676 . . . . 0.0 110.554 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.8 -55.52 22.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.553 0.741 . . . . 0.0 110.225 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.64 -50.24 70.73 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.856 0.463 . . . . 0.0 110.24 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 tt -55.8 -53.5 55.89 Favored 'General case' 0 N--CA 1.457 -0.099 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -59.91 -36.86 77.88 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 119.49 -0.29 . . . . 0.0 110.941 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -73.83 60.85 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.458 0.572 . . . . 0.0 109.992 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 p -53.79 -37.17 63.21 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.481 1.113 . . . . 0.0 111.175 178.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.45 -22.98 66.82 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.007 0.523 . . . . 0.0 112.076 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.48 31.48 80.37 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 111.511 -0.635 . . . . 0.0 111.511 -173.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -24.16 65.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.73 0.765 . . . . 0.0 111.909 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.4 61.36 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.824 1.202 . . . . 0.0 110.332 -169.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -138.27 144.99 40.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.952 1.701 . . . . 0.0 107.09 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.5 mt -80.82 116.81 25.73 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.062 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -65.98 147.44 53.35 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.11 0.868 . . . . 0.0 110.3 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.76 -46.76 1.3 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.782 0.833 . . . . 0.0 113.213 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.02 -46.41 89.58 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.806 -0.559 . . . . 0.0 111.233 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.51 -38.81 88.72 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.014 -0.429 . . . . 0.0 109.904 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.8 -43.49 98.66 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.843 -0.536 . . . . 0.0 110.389 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -57.02 -48.75 77.75 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.474 -0.766 . . . . 0.0 110.096 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -55.05 -48.03 76.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.731 -0.605 . . . . 0.0 110.551 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.85 70.48 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.873 0.469 . . . . 0.0 110.633 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.3 mtm -61.6 -38.03 86.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.737 -0.602 . . . . 0.0 111.583 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -60.94 -43.41 98.71 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.464 -0.773 . . . . 0.0 111.355 169.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.45 77.09 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.023 0.829 . . . . 0.0 111.331 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.47 -0.62 13.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.088 0.955 . . . . 0.0 112.501 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.66 24.05 68.46 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.406 1.003 . . . . 0.0 112.709 175.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -80.03 165.95 22.03 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.084 0.942 . . . . 0.0 110.525 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -116.19 92.85 37.24 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.737 1.615 . . . . 0.0 107.835 170.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -53.17 140.08 61.63 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.952 3.101 . . . . 0.0 112.98 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -135.95 119.17 16.63 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -40.31 -58.52 1.5 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.289 1.436 . . . . 0.0 114.633 -169.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -51.41 69.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.774 0.43 . . . . 0.0 111.674 -177.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -57.45 -50.69 72.19 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.921 0.488 . . . . 0.0 110.038 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.76 -54.22 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 123.998 0.919 . . . . 0.0 109.786 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -55.44 -50.95 68.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.444 0.697 . . . . 0.0 110.593 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.7 -51.45 67.15 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -177.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.77 -53.29 56.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.222 0.609 . . . . 0.0 110.071 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -50.67 -49.37 25.7 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.783 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -58.64 -44.73 90.16 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.566 1.075 . . . . 0.0 111.471 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -58.67 -47.78 83.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.432 0.293 . . . . 0.0 110.744 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 34.6 mm -71.6 -34.66 53.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 120.716 0.293 . . . . 0.0 110.772 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -81.08 70.45 7.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 109.442 -174.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -62.55 -40.97 98.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.244 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -138.72 -28.92 0.8 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.351 1.061 . . . . 0.0 113.438 -172.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.18 -12.07 22.2 Favored Glycine 0 CA--C 1.539 1.559 0 N-CA-C 115.632 1.013 . . . . 0.0 115.632 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.1 m 48.13 67.23 0.87 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.747 1.619 . . . . 0.0 113.265 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.43 -19.71 50.94 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -113.54 166.46 11.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.6 mm -118.54 116.88 52.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 125.622 1.569 . . . . 0.0 107.142 176.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.16 160.6 32.17 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.561 1.144 . . . . 0.0 110.651 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -48.68 -48.72 39.83 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.368 0.667 . . . . 0.0 111.781 176.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -63.93 -40.65 96.94 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.787 0.721 . . . . 0.0 111.356 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -62.77 -47.46 83.39 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.68 -0.638 . . . . 0.0 109.654 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -59.31 -46.63 88.06 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.415 0.686 . . . . 0.0 110.715 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.16 -48.17 74.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.693 1.197 . . . . 0.0 109.509 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.3 m -56.75 -51.09 70.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.288 0.494 . . . . 0.0 110.432 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.7 ttp -51.8 -52.08 51.69 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 176.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -39.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.092 0.557 . . . . 0.0 111.077 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.8 m -58.46 -46.08 87.3 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.394 0.543 . . . . 0.0 109.849 175.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.86 -52.6 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.239 0.216 . . . . 0.0 111.433 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -81.12 -38.26 27.51 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.234 0.614 . . . . 0.0 112.605 -169.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.7 mtp . . . . . 0 C--O 1.252 1.208 0 CA-C-O 116.388 -1.768 . . . . 0.0 111.1 -169.883 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.5 t -74.93 74.85 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -176.02 -168.24 35.99 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 mt -69.46 107.49 3.37 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 117.25 0.525 . . . . 0.0 110.233 177.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.7 p -64.73 164.96 11.17 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.984 0.421 . . . . 0.0 109.883 171.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -50.81 -47.14 60.06 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.43 -52.38 46.67 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.352 0.661 . . . . 0.0 110.677 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -57.45 -48.52 78.96 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.147 -0.346 . . . . 0.0 110.62 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -58.52 -40.49 83.07 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.602 0.637 . . . . 0.0 111.707 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -58.33 -52.66 64.68 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.51 0.724 . . . . 0.0 109.838 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.43 -45.97 87.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.202 -0.311 . . . . 0.0 111.352 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.47 -46.45 82.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.729 0.812 . . . . 0.0 109.597 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -61.64 -44.95 96.01 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.383 0.538 . . . . 0.0 111.013 177.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -55.88 -55.25 34.86 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.456 0.571 . . . . 0.0 110.114 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.77 -49.46 70.83 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.871 0.468 . . . . 0.0 110.03 178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -51.82 -52.68 47.46 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.887 0.475 . . . . 0.0 110.733 177.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.53 -49.17 75.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.755 0.822 . . . . 0.0 110.606 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 tp -53.37 -54.77 31.83 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -61.58 -43.05 99.58 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.456 -0.152 . . . . 0.0 110.909 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.99 62.69 1.15 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.696 1.198 . . . . 0.0 109.547 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 75.0 p -54.24 -33.06 57.56 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.131 0.972 . . . . 0.0 111.169 173.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -63.87 -22.26 66.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.155 0.582 . . . . 0.0 112.249 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.68 28.73 72.03 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.958 0.789 . . . . 0.0 112.132 -177.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.0 p -92.32 9.08 35.51 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.072 0.949 . . . . 0.0 112.64 -173.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.16 16.66 62.6 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.128 0.87 . . . . 0.0 111.545 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.3 p -148.33 121.71 9.05 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.109 1.764 . . . . 0.0 107.536 -169.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.37 110.38 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 169.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.73 148.68 45.97 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.24 -46.24 1.49 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.551 1.14 . . . . 0.0 113.062 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -59.18 -48.03 83.12 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.061 0.457 . . . . 0.0 110.926 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -61.51 -39.69 91.9 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 122.017 -0.427 . . . . 0.0 109.942 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.2 tp -63.56 -42.56 98.34 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.611 -0.681 . . . . 0.0 110.383 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.74 -48.04 80.75 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.687 -0.633 . . . . 0.0 110.168 175.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -54.23 -49.46 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 122.014 -0.429 . . . . 0.0 110.554 173.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.79 -49.08 69.1 Favored 'General case' 0 C--O 1.225 -0.204 0 O-C-N 121.993 -0.442 . . . . 0.0 110.675 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -61.13 -39.88 91.7 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.084 0.554 . . . . 0.0 111.382 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -60.13 -43.35 95.73 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.245 -0.91 . . . . 0.0 111.437 170.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.85 -37.77 77.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.951 0.796 . . . . 0.0 111.346 173.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -72.82 -0.84 14.52 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.042 0.937 . . . . 0.0 112.647 173.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.43 25.67 69.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.318 0.961 . . . . 0.0 112.616 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -82.55 167.06 18.72 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 117.791 0.796 . . . . 0.0 111.035 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -109.35 107.23 59.5 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 169.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -56.87 77.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.638 3.559 . . . . 0.0 114.459 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -65.84 82.5 0.07 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.364 1.066 . . . . 0.0 109.044 170.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -31.29 -55.4 0.24 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 127.817 2.447 . . . . 0.0 114.288 -169.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 mp0 -59.33 -53.27 60.15 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.33 0.586 . . . . 0.0 110.134 -176.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -62.68 -41.66 99.22 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.764 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.99 -52.83 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.095 0.558 . . . . 0.0 109.89 174.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -51.3 70.15 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -53.34 -56.12 19.31 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.483 0.313 . . . . 0.0 110.577 178.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.0 ttp -50.89 -57.92 7.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.303 0.641 . . . . 0.0 110.103 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -51.47 -44.22 32.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 122.724 0.41 . . . . 0.0 110.022 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.2 m -61.75 -49.44 76.41 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.185 0.448 . . . . 0.0 111.558 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -58.09 -45.22 87.53 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.055 0.389 . . . . 0.0 110.848 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.02 -34.21 49.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.241 -0.287 . . . . 0.0 111.101 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -89.46 88.45 7.46 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.65 0.659 . . . . 0.0 110.35 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -19.43 65.99 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.72 0.808 . . . . 0.0 112.246 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -81.8 -44.88 16.36 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.91 -15.75 33.72 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.285 1.422 . . . . 0.0 113.334 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.7 m -78.48 38.82 0.32 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.328 1.564 . . . . 0.0 114.048 -169.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 53.74 39.21 60.91 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.583 1.087 . . . . 0.0 113.059 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.0 p -137.62 124.62 21.43 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.746 1.219 . . . . 0.0 109.602 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.5 mm -91.59 104.34 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.83 151.3 39.37 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -45.41 -47.98 13.64 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.39 -42.35 86.91 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.499 0.591 . . . . 0.0 111.202 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -66.1 -45.38 81.39 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -55.9 -49.94 72.04 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.697 0.399 . . . . 0.0 110.439 174.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -54.28 -49.75 68.89 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 108.902 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.6 m -55.85 -49.68 72.67 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.932 -0.48 . . . . 0.0 111.087 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.7 ttp -54.0 -51.54 63.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.827 -0.545 . . . . 0.0 110.156 177.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 91.4 mmm -62.93 -33.49 75.47 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 122.026 -0.422 . . . . 0.0 111.559 178.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 31.5 m -63.02 -41.7 99.61 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.669 0.668 . . . . 0.0 110.001 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.43 -49.27 69.81 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.123 -0.361 . . . . 0.0 110.676 176.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.22 -49.58 59.76 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 37.9 mtm . . . . . 0 C--O 1.251 1.153 0 C-N-CA 125.053 1.341 . . . . 0.0 110.837 -169.313 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.1 m -52.87 121.65 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 128.72 -38.59 2.02 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -169.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.3 mt -57.82 130.93 48.7 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 169.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -65.3 155.08 36.38 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -178.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -53.32 -36.07 60.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.166 -0.334 . . . . 0.0 110.112 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.92 -58.12 9.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.948 0.499 . . . . 0.0 110.307 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -52.67 -47.61 67.05 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.86 -0.525 . . . . 0.0 110.685 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -57.61 -44.57 85.56 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.228 -0.295 . . . . 0.0 110.802 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.07 88.11 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.902 -0.499 . . . . 0.0 110.25 177.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -58.13 -48.89 78.83 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 110.225 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -58.58 -41.27 81.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -61.84 -47.7 83.91 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.728 -0.607 . . . . 0.0 111.237 175.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -56.8 -49.31 75.74 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.73 0.695 . . . . 0.0 110.38 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.05 -50.01 67.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.559 0.344 . . . . 0.0 110.736 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -51.77 -57.5 9.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.343 0.657 . . . . 0.0 110.725 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -57.54 -45.71 84.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 110.69 -177.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 tt -56.24 -53.16 60.51 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.0 -37.34 79.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.746 -0.168 . . . . 0.0 110.907 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -73.66 59.82 0.66 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.174 0.443 . . . . 0.0 110.283 170.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 68.2 p -53.23 -36.42 61.02 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.37 1.068 . . . . 0.0 111.158 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.76 -23.24 67.18 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.382 0.673 . . . . 0.0 112.185 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.56 30.33 77.21 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.733 -0.547 . . . . 0.0 111.733 -174.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -24.39 65.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.839 0.82 . . . . 0.0 111.94 178.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.15 -10.28 65.56 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 124.684 1.135 . . . . 0.0 110.507 -169.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p -141.0 145.5 36.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.313 1.845 . . . . 0.0 106.653 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 95.1 mt -82.87 120.08 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.15 146.26 53.59 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.422 1.01 . . . . 0.0 110.426 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.49 -48.33 0.97 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.895 0.878 . . . . 0.0 113.192 173.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.28 -48.27 81.01 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.939 0.496 . . . . 0.0 111.217 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -60.72 -39.51 88.89 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.766 0.426 . . . . 0.0 110.118 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.02 -40.86 99.03 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.869 -0.52 . . . . 0.0 110.549 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -61.07 -47.28 87.09 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.626 -0.671 . . . . 0.0 110.67 174.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -52.86 -50.47 43.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.446 0.566 . . . . 0.0 110.145 173.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.53 -53.65 48.58 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.16 0.584 . . . . 0.0 110.408 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.8 mtm -56.35 -46.1 80.15 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.387 0.675 . . . . 0.0 111.874 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -54.46 -51.02 66.32 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.437 0.562 . . . . 0.0 110.726 172.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.77 73.8 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.966 -0.459 . . . . 0.0 111.763 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.5 mt -74.99 -0.58 19.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.764 1.226 . . . . 0.0 112.258 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.75 25.05 63.41 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 119.189 0.904 . . . . 0.0 112.878 176.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -76.8 166.19 23.68 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.953 0.876 . . . . 0.0 109.259 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -108.77 109.93 61.19 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -58.48 66.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 124.764 3.643 . . . . 0.0 115.94 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.94 90.16 0.43 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 171.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -31.42 -52.28 0.21 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.97 2.108 . . . . 0.0 113.966 -172.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -62.12 -49.11 77.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.341 0.656 . . . . 0.0 110.639 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.68 -47.45 86.2 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.984 0.913 . . . . 0.0 109.307 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.7 mm -54.7 -53.64 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -57.58 -49.39 76.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.615 0.766 . . . . 0.0 110.387 -179.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -54.81 -56.91 14.29 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.453 0.301 . . . . 0.0 110.257 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.3 ttp -51.74 -56.97 10.66 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.793 0.437 . . . . 0.0 110.355 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.51 -50.6 21.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 123.047 0.539 . . . . 0.0 109.631 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.6 m -58.5 -49.07 78.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.312 0.505 . . . . 0.0 111.447 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -56.78 -44.76 82.17 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.85 0.296 . . . . 0.0 111.079 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.3 mm -71.51 -35.09 55.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 121.997 -0.44 . . . . 0.0 111.118 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -80.12 73.92 6.93 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.563 0.745 . . . . 0.0 110.744 -170.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -66.71 -39.69 88.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.232 0.613 . . . . 0.0 111.727 173.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -130.53 -44.02 1.12 Allowed 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.781 1.232 . . . . 0.0 112.494 -169.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -53.97 -15.62 5.21 Favored Glycine 0 CA--C 1.54 1.643 0 N-CA-C 117.086 1.594 . . . . 0.0 117.086 -169.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 m 47.43 65.3 1.3 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.474 1.51 . . . . 0.0 112.938 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.72 -27.19 20.02 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.6 p -105.95 170.24 8.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -121.46 119.21 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.671 1.588 . . . . 0.0 107.153 177.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.2 157.51 37.6 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.751 0.82 . . . . 0.0 110.479 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -47.14 -50.15 20.91 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 123.515 0.726 . . . . 0.0 112.081 177.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -61.11 -39.81 91.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.41 0.55 . . . . 0.0 111.203 -178.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -66.38 -46.64 75.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.671 0.789 . . . . 0.0 109.75 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -56.4 -46.97 79.91 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.17 0.588 . . . . 0.0 110.331 174.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.68 -45.73 81.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.643 0.777 . . . . 0.0 109.213 176.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.9 m -53.43 -54.24 39.74 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.797 -0.564 . . . . 0.0 110.879 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -53.62 -51.85 61.73 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.081 0.552 . . . . 0.0 110.15 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -56.87 -48.68 77.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.279 0.632 . . . . 0.0 110.06 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.1 m -55.2 -48.37 73.93 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.224 0.61 . . . . 0.0 110.358 177.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.41 97.72 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.556 0.342 . . . . 0.0 111.427 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -65.28 -46.19 81.44 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.338 0.655 . . . . 0.0 110.961 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 67.5 mtm . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.783 -1.58 . . . . 0.0 111.023 179.136 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.3 m -76.35 63.37 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.877 0.871 . . . . 0.0 109.474 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.2 -67.97 1.43 Allowed Glycine 0 CA--C 1.528 0.844 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.84 123.26 19.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 59.9 p -65.44 162.33 18.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.364 0.602 . . . . 0.0 110.262 175.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -55.16 -42.63 73.35 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 169.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.61 -57.45 8.19 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.834 0.854 . . . . 0.0 110.485 173.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -56.0 -49.12 74.51 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.155 -0.34 . . . . 0.0 111.29 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -60.37 -40.88 92.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.173 -179.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -58.37 -52.02 67.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.1 0.409 . . . . 0.0 110.748 172.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -50.78 -49.47 58.2 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.564 0.62 . . . . 0.0 110.595 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.25 -45.08 93.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 122.976 0.51 . . . . 0.0 110.395 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.04 95.8 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 111.885 178.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -44.38 70.82 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 109.951 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.16 -49.38 71.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.898 -0.501 . . . . 0.0 109.854 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -52.42 -51.44 59.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.274 0.63 . . . . 0.0 110.357 175.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -52.87 -53.17 52.89 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.839 0.455 . . . . 0.0 111.211 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -53.88 -53.82 47.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.947 0.499 . . . . 0.0 109.848 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -59.62 -39.19 83.48 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.812 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -73.57 60.61 0.67 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.37 0.532 . . . . 0.0 109.97 171.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.8 p -51.25 -42.22 60.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.945 1.298 . . . . 0.0 111.58 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.17 -21.59 64.89 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.71 35.98 74.61 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -174.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 m -72.11 -15.49 61.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 117.5 0.65 . . . . 0.0 112.374 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.66 -40.13 2.6 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 109.851 -1.3 . . . . 0.0 109.851 -172.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.0 p -116.19 142.25 47.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.395 1.478 . . . . 0.0 109.06 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.0 mt -74.36 124.19 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.078 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -71.53 147.07 48.07 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.009 0.822 . . . . 0.0 110.193 172.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.0 -49.4 0.82 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.158 0.983 . . . . 0.0 113.317 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.46 -46.18 87.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.845 -0.534 . . . . 0.0 111.163 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.54 -39.36 93.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.67 0.388 . . . . 0.0 110.192 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.05 -44.3 96.98 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.757 -0.59 . . . . 0.0 110.016 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.54 -46.84 85.99 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.44 -0.787 . . . . 0.0 110.918 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -52.7 -51.9 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 118.3 0.5 . . . . 0.0 110.113 171.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.03 -53.86 43.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.837 0.455 . . . . 0.0 110.594 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.8 mtm -60.47 -41.45 94.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.153 0.581 . . . . 0.0 111.666 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.65 -48.36 79.67 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.22 -37.95 81.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.16 0.584 . . . . 0.0 111.626 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.0 mt -69.5 -1.31 8.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.202 1.001 . . . . 0.0 111.936 173.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.33 8.26 74.95 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.49 1.043 . . . . 0.0 112.504 174.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -73.79 162.63 28.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.557 1.178 . . . . 0.0 109.1 -177.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -104.73 91.76 4.49 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.35 75.48 2.41 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.14 1.893 . . . . 0.0 112.794 -173.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -64.85 123.08 18.45 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.716 0.806 . . . . 0.0 109.736 171.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -42.16 -59.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.83 1.652 . . . . 0.0 113.298 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mp0 -61.26 -49.87 75.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.365 0.602 . . . . 0.0 109.999 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -57.83 -47.27 83.14 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.159 0.984 . . . . 0.0 109.452 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.6 mm -61.97 -46.67 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 122.804 0.441 . . . . 0.0 110.897 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -56.53 -48.73 76.65 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.561 0.618 . . . . 0.0 110.141 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -57.07 -56.31 23.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.41 0.284 . . . . 0.0 110.421 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -49.67 -57.66 6.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.395 1.478 . . . . 0.0 110.995 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.1 mt -51.67 -50.94 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 123.233 0.613 . . . . 0.0 109.66 177.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.7 m -57.87 -46.19 85.24 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.551 0.614 . . . . 0.0 111.825 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -57.23 -46.25 83.14 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 117.841 0.292 . . . . 0.0 110.931 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.72 -34.66 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 122.336 -0.228 . . . . 0.0 111.285 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -77.01 75.91 3.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.331 0.652 . . . . 0.0 111.014 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -67.84 -48.71 65.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.162 0.585 . . . . 0.0 110.822 173.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -128.43 -27.08 2.69 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.728 1.211 . . . . 0.0 112.689 -169.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.89 -17.22 50.16 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 123.48 0.562 . . . . 0.0 114.496 -171.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.4 m 49.66 62.05 2.84 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.296 1.438 . . . . 0.0 112.174 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.28 -29.76 10.26 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 p -102.85 175.67 5.41 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.4 mm -125.52 118.59 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.938 1.695 . . . . 0.0 106.945 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.5 158.88 34.07 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.963 0.905 . . . . 0.0 110.679 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -48.8 -48.18 41.55 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 123.246 0.618 . . . . 0.0 111.551 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -59.85 -48.32 82.15 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.393 0.542 . . . . 0.0 110.877 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.01 -47.25 83.62 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.923 0.489 . . . . 0.0 109.848 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -58.06 -49.38 77.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.324 0.65 . . . . 0.0 111.223 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.39 -47.33 79.17 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.605 0.762 . . . . 0.0 109.041 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.1 m -57.17 -52.16 66.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.897 0.479 . . . . 0.0 110.397 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -52.64 -53.99 39.43 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.979 0.911 . . . . 0.0 110.222 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.8 tpt -54.59 -54.15 45.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.829 0.852 . . . . 0.0 109.681 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -53.25 -48.43 68.24 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.139 0.576 . . . . 0.0 110.337 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.77 -12.62 11.24 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -60.44 -30.57 69.73 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.407 1.003 . . . . 0.0 111.095 171.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 20.4 ptt? . . . . . 0 C--O 1.25 1.125 0 CA-C-O 116.895 -1.526 . . . . 0.0 110.233 171.351 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.3 m -68.45 140.22 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 172.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 169.15 -158.52 31.08 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 50.8 mt -102.16 104.33 14.92 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.87 0.868 . . . . 0.0 109.633 174.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.0 p -64.8 166.78 8.44 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.304 0.574 . . . . 0.0 109.929 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -52.9 -45.65 67.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 121.768 -0.583 . . . . 0.0 109.947 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.09 -56.84 10.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.681 0.792 . . . . 0.0 110.214 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.55 -44.35 72.8 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 119.563 -0.256 . . . . 0.0 111.056 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -60.79 -39.56 89.35 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.73 0.695 . . . . 0.0 111.834 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -61.81 -49.61 75.64 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.657 0.662 . . . . 0.0 109.42 175.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -53.44 -48.89 68.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.622 0.369 . . . . 0.0 110.459 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -57.49 -44.91 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.937 0.895 . . . . 0.0 110.365 176.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -59.3 -51.65 69.02 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.438 0.563 . . . . 0.0 110.944 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -57.59 -47.38 82.29 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.055 -0.403 . . . . 0.0 110.596 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.94 -52.81 59.44 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.777 0.431 . . . . 0.0 110.306 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.12 -54.84 21.41 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 121.302 0.573 . . . . 0.0 110.469 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.16 -49.77 71.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.984 0.914 . . . . 0.0 110.424 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.03 -53.25 60.23 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.066 0.547 . . . . 0.0 110.502 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -59.5 -34.37 72.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.265 -176.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.04 58.48 0.49 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.516 0.598 . . . . 0.0 110.536 170.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 69.3 p -54.91 -38.3 67.45 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.58 1.152 . . . . 0.0 110.998 178.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -65.43 -19.16 65.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.427 0.691 . . . . 0.0 112.238 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.32 32.23 83.45 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.565 0.62 . . . . 0.0 111.555 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.74 -15.54 60.77 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.932 0.893 . . . . 0.0 112.249 -178.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.57 -39.73 2.84 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -174.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -106.18 145.06 32.0 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.284 1.433 . . . . 0.0 108.561 171.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.3 mt -78.0 121.0 29.84 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.67 146.57 54.64 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.971 0.805 . . . . 0.0 110.427 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.94 -48.93 1.64 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.784 0.834 . . . . 0.0 113.023 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -60.64 -45.14 95.2 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.994 0.518 . . . . 0.0 111.23 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -60.28 -42.45 95.46 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.64 -43.15 99.4 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.566 0.621 . . . . 0.0 110.487 176.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.03 -47.64 84.5 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.553 -0.717 . . . . 0.0 110.864 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.33 -42.42 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 122.895 0.478 . . . . 0.0 110.595 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.84 -54.98 40.77 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.575 -0.703 . . . . 0.0 110.252 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 63.3 mtm -56.46 -47.29 79.5 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.359 0.664 . . . . 0.0 110.736 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -49.81 -55.05 15.63 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.388 0.275 . . . . 0.0 110.591 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.35 81.65 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.615 0.766 . . . . 0.0 111.624 179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.0 mt -66.66 -6.32 15.07 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 112.053 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.28 15.92 45.74 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 118.983 0.811 . . . . 0.0 112.449 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -76.45 165.94 24.11 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.126 0.963 . . . . 0.0 109.437 172.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -113.57 97.9 45.25 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 105.445 -2.057 . . . . 0.0 105.445 169.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -54.47 88.28 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.837 3.025 . . . . 0.0 115.208 -173.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -66.52 82.38 0.1 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.069 0.948 . . . . 0.0 109.828 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -30.96 -58.49 0.22 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.605 2.362 . . . . 0.0 114.44 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -62.29 -51.33 68.1 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.856 -0.528 . . . . 0.0 110.568 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -59.84 -44.73 93.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.521 0.728 . . . . 0.0 110.145 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -53.2 -54.57 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.911 0.884 . . . . 0.0 109.924 175.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -57.61 -48.37 79.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.825 0.45 . . . . 0.0 110.898 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -55.84 -55.18 35.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.696 0.226 . . . . 0.0 110.499 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 48.7 ttp -53.35 -55.26 26.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.29 0.636 . . . . 0.0 110.238 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.3 mt -49.02 -50.54 14.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 123.219 0.608 . . . . 0.0 109.598 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -58.51 -48.31 81.26 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.47 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.88 -42.35 84.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.767 0.427 . . . . 0.0 111.362 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 51.6 mm -74.07 -34.46 38.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 117.966 0.348 . . . . 0.0 111.031 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -76.5 75.45 3.23 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.472 1.109 . . . . 0.0 110.029 -177.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -56.23 -21.92 26.4 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -172.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -109.59 6.18 23.69 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.19 0.905 . . . . 0.0 111.349 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.08 40.95 44.94 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.866 1.222 . . . . 0.0 113.264 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.0 p -78.43 -14.92 59.16 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 112.779 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.77 9.63 77.63 Favored Glycine 0 CA--C 1.534 1.259 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -168.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.7 p -138.74 159.23 42.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.66 0.784 . . . . 0.0 110.396 -173.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.9 mm -111.49 120.38 61.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.358 1.463 . . . . 0.0 108.299 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.37 153.94 35.34 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.31 0.644 . . . . 0.0 110.397 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -50.66 -43.37 57.28 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.346 0.658 . . . . 0.0 112.34 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.9 -45.61 93.93 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.472 0.578 . . . . 0.0 110.759 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -62.14 -46.85 87.15 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -56.41 -50.42 71.67 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.774 0.83 . . . . 0.0 110.877 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.3 tp -57.62 -44.64 85.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.44 0.696 . . . . 0.0 109.995 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.4 m -58.54 -50.07 75.11 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.951 -0.468 . . . . 0.0 110.378 176.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -54.98 -47.0 75.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.838 0.855 . . . . 0.0 110.521 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -56.21 -55.95 26.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.135 -0.353 . . . . 0.0 110.521 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -52.92 -39.21 62.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.071 0.948 . . . . 0.0 111.504 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.41 -37.96 73.57 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.457 0.303 . . . . 0.0 111.589 177.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -81.58 -49.86 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.102 0.41 . . . . 0.0 110.544 177.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . 0.273 3.6 ppp? . . . . . 0 C--O 1.251 1.136 0 C-N-CA 127.438 2.295 . . . . 0.0 114.066 -171.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 120.957 0.408 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.464 HG22 ' H ' ' A' ' 3' ' ' GLY . 12.8 p -68.93 179.0 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 169.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.464 ' H ' HG22 ' A' ' 2' ' ' VAL . . . -42.68 -34.38 1.79 Allowed Glycine 0 CA--C 1.532 1.15 0 C-N-CA 124.911 1.243 . . . . 0.0 113.471 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 39.4 mt -83.96 100.83 11.28 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.907 0.883 . . . . 0.0 110.169 169.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.2 p -64.74 168.87 5.61 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -52.18 -45.76 65.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.884 -0.51 . . . . 0.0 110.58 172.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -53.29 -55.69 22.58 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.711 0.805 . . . . 0.0 110.389 176.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -55.05 -44.31 74.59 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.488 -0.292 . . . . 0.0 110.563 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -60.0 -39.25 85.12 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.818 0.735 . . . . 0.0 111.659 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -62.16 -50.27 72.51 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.188 0.903 . . . . 0.0 109.721 176.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -53.48 -49.61 67.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.033 0.445 . . . . 0.0 110.172 177.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.3 mt -60.89 -41.34 88.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.49 1.116 . . . . 0.0 110.435 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.11 -47.14 85.91 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.878 0.763 . . . . 0.0 110.683 175.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -55.95 -54.68 41.82 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.73 -49.23 68.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.165 0.586 . . . . 0.0 110.446 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -52.22 -56.08 17.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.894 0.878 . . . . 0.0 110.702 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -54.5 -49.97 68.92 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 110.583 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -56.39 -53.85 52.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.198 0.199 . . . . 0.0 110.607 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -60.19 -35.17 74.77 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.454 0.302 . . . . 0.0 111.065 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -72.35 58.47 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.218 0.607 . . . . 0.0 110.421 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.2 p -55.41 -36.95 67.0 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 110.967 177.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -65.64 -17.65 64.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.379 0.672 . . . . 0.0 112.401 177.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.93 31.14 79.95 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.773 0.715 . . . . 0.0 111.984 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.81 5.45 25.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.89 1.276 . . . . 0.0 112.844 -179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.4 12.08 37.38 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.499 1.523 . . . . 0.0 111.915 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 42.5 p -156.63 135.32 11.64 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 104.751 -2.315 . . . . 0.0 104.751 -169.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.1 mt -85.07 116.25 28.23 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -63.88 144.24 57.22 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.82 0.737 . . . . 0.0 109.767 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.21 -46.31 1.48 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 174.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -54.99 -52.65 62.43 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.385 0.674 . . . . 0.0 111.019 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -58.19 -38.92 77.66 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.026 0.531 . . . . 0.0 109.912 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.2 tp -65.37 -45.69 83.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.512 0.596 . . . . 0.0 111.551 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.282 20.3 pttp -62.28 -39.4 92.81 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.88 -1.137 . . . . 0.0 111.673 175.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.8 -50.35 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.346 0.521 . . . . 0.0 110.151 171.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -53.03 57.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.875 0.87 . . . . 0.0 110.309 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtm -57.28 -42.21 81.21 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.736 0.414 . . . . 0.0 111.421 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -56.15 18.01 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 172.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.79 -39.12 73.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.197 0.599 . . . . 0.0 112.003 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.1 mt -70.64 -6.79 39.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.53 1.132 . . . . 0.0 112.539 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.4 22.61 36.81 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.456 1.025 . . . . 0.0 112.774 175.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -76.19 -179.2 4.88 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.211 1.005 . . . . 0.0 109.916 174.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.36 102.87 36.04 Favored Pre-proline 0 N--CA 1.452 -0.359 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 169.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -59.96 69.8 0.07 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.021 3.147 . . . . 0.0 115.699 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.49 88.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -32.15 -49.33 0.19 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.0 2.12 . . . . 0.0 115.074 -173.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -60.98 -48.27 82.6 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.571 0.623 . . . . 0.0 111.144 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -68.53 -42.43 78.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.457 0.703 . . . . 0.0 109.577 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mm -52.72 -57.69 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.329 0.651 . . . . 0.0 109.336 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -54.68 -51.05 66.74 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.805 0.842 . . . . 0.0 110.475 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -54.16 -57.92 9.33 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.197 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.3 ttp -56.92 -53.04 62.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.494 0.317 . . . . 0.0 110.254 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.4 mt -50.19 -49.79 21.84 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.299 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.2 m -58.3 -48.39 80.64 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.372 0.533 . . . . 0.0 111.482 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -57.72 -45.07 86.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.424 0.29 . . . . 0.0 111.401 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.4 mm -71.69 -33.62 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 122.206 -0.308 . . . . 0.0 110.832 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -75.81 69.84 2.51 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.03 0.932 . . . . 0.0 110.163 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.95 -41.89 92.88 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.586 1.154 . . . . 0.0 110.875 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -142.48 -27.49 0.61 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.306 1.042 . . . . 0.0 113.658 -169.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.1 -13.2 26.48 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 -172.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m 50.13 65.73 1.35 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.488 1.515 . . . . 0.0 112.849 169.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.96 -25.13 26.76 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -178.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.5 p -106.63 167.71 9.67 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.9 mm -121.04 113.7 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.775 1.63 . . . . 0.0 106.804 173.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -71.56 159.32 34.66 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.402 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -50.94 -43.86 60.25 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.259 0.624 . . . . 0.0 112.03 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.91 -48.52 81.35 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.387 0.54 . . . . 0.0 110.722 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -60.11 -47.44 85.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.852 0.461 . . . . 0.0 109.931 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -56.88 -50.37 72.69 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.755 0.822 . . . . 0.0 110.456 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.64 -44.17 89.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.389 0.676 . . . . 0.0 109.88 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.0 m -56.97 -49.61 75.19 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.907 -0.496 . . . . 0.0 110.221 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 61.2 ttp -52.67 -50.94 62.25 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.9 mmt -59.5 -42.24 91.73 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.6 m -59.55 -47.66 84.67 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.428 0.691 . . . . 0.0 109.989 177.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.64 -44.99 93.3 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.746 0.418 . . . . 0.0 110.97 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -66.21 -45.11 81.9 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.273 0.229 . . . . 0.0 111.289 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 35.3 ttp . . . . . 0 C--O 1.25 1.126 0 C-N-CA 125.971 1.708 . . . . 0.0 109.252 -169.79 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.0 mtt85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 110.783 -0.08 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.39 59.61 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.665 0.786 . . . . 0.0 109.614 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.61 -61.76 1.97 Allowed Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.279 -1.529 . . . . 0.0 109.279 -169.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.87 114.02 3.4 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.908 0.883 . . . . 0.0 110.356 174.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.9 p -70.07 170.17 11.98 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -55.77 -36.75 67.69 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.745 -0.597 . . . . 0.0 110.519 169.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -68.95 -46.36 68.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.668 -0.645 . . . . 0.0 109.562 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.39 -43.06 88.37 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.457 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.37 -45.78 92.29 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.921 0.782 . . . . 0.0 111.166 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -54.36 -54.3 42.35 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.15 0.432 . . . . 0.0 110.232 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -54.25 -46.78 72.69 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.257 0.623 . . . . 0.0 111.054 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.0 mt -59.59 -45.97 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.307 0.643 . . . . 0.0 110.3 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -60.15 -45.94 91.37 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.653 -0.655 . . . . 0.0 110.879 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -57.19 -51.72 68.2 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.072 0.549 . . . . 0.0 110.323 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -49.39 72.03 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.84 0.456 . . . . 0.0 110.691 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -52.79 -57.17 11.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.48 0.712 . . . . 0.0 110.263 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -52.46 -50.56 62.41 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.241 1.016 . . . . 0.0 110.836 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.23 -54.71 43.73 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -59.86 -33.58 71.99 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.424 -0.172 . . . . 0.0 111.044 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -72.51 51.55 0.26 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.449 1.099 . . . . 0.0 110.796 172.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 66.4 p -52.85 -37.09 59.81 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.934 1.294 . . . . 0.0 111.618 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.33 -22.04 66.82 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.558 0.743 . . . . 0.0 112.639 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.79 22.8 73.98 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 121.723 -0.611 . . . . 0.0 111.761 -175.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.1 p -75.11 -10.86 59.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.713 1.605 . . . . 0.0 112.616 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.6 14.62 50.85 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.24 0.924 . . . . 0.0 111.854 -173.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.7 p -155.48 120.55 4.84 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -173.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -78.95 122.19 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.67 145.32 48.97 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 174.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.99 -48.24 0.76 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.615 1.166 . . . . 0.0 113.052 172.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.75 -48.62 80.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.021 0.528 . . . . 0.0 111.111 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -59.99 -42.47 94.29 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.027 -0.421 . . . . 0.0 109.888 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -62.64 -40.86 98.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.947 -0.471 . . . . 0.0 110.534 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -60.23 -47.76 84.59 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.6 t -54.55 -48.97 69.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 CA-C-N 118.216 0.462 . . . . 0.0 110.2 173.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.75 -51.17 64.23 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.163 -0.336 . . . . 0.0 110.592 176.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.9 mtm -59.21 -42.09 90.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.377 0.671 . . . . 0.0 111.948 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -57.69 -49.41 76.6 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.516 0.598 . . . . 0.0 110.018 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.95 -39.15 77.39 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.947 -0.471 . . . . 0.0 111.63 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -72.37 -1.88 17.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.528 1.131 . . . . 0.0 112.337 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 27.12 72.11 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-N 119.054 0.843 . . . . 0.0 112.373 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -80.78 164.07 23.01 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -106.05 92.51 6.62 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 107.634 -1.246 . . . . 0.0 107.634 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -75.8 75.84 3.91 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.115 1.876 . . . . 0.0 112.227 -169.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.14 98.68 0.11 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.692 1.197 . . . . 0.0 110.128 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -31.71 -57.09 0.28 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.314 2.245 . . . . 0.0 113.867 -174.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -51.71 -49.88 61.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.234 0.614 . . . . 0.0 111.176 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -70.5 -41.75 72.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 mm -57.0 -46.77 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.141 0.576 . . . . 0.0 110.995 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -55.52 -51.54 66.66 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.297 0.499 . . . . 0.0 110.421 177.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -59.37 -51.42 69.98 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.291 -0.255 . . . . 0.0 110.695 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.8 ttp -50.0 -56.79 9.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.535 0.734 . . . . 0.0 109.974 177.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -50.65 -49.72 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 C-N-CA 123.526 0.73 . . . . 0.0 109.563 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 p -58.56 -47.02 85.63 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.479 0.581 . . . . 0.0 111.219 -178.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -60.56 -43.42 97.28 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.642 0.777 . . . . 0.0 110.903 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.5 mm -71.53 -34.15 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 O-C-N 122.218 -0.301 . . . . 0.0 110.766 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -78.47 67.31 4.22 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.586 -0.696 . . . . 0.0 110.559 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -47.35 -33.09 5.43 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.921 1.688 . . . . 0.0 113.028 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -97.86 9.44 42.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.849 1.26 . . . . 0.0 109.923 -173.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 35.85 40.74 0.36 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 127.428 2.442 . . . . 0.0 114.173 -175.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -89.29 19.38 4.41 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.222 0.609 . . . . 0.0 112.366 -170.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 55.97 18.52 19.21 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.756 1.17 . . . . 0.0 112.973 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.4 p -161.32 161.56 30.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -170.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.8 mm -99.88 110.09 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.18 158.07 36.47 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.578 0.751 . . . . 0.0 110.299 170.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.46 -47.74 38.1 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.707 0.803 . . . . 0.0 112.24 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.51 -40.73 95.65 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.356 0.525 . . . . 0.0 110.733 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -65.6 -45.93 81.29 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.32 -47.31 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.65 0.78 . . . . 0.0 111.1 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.1 tp -57.15 -49.02 77.26 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.527 0.731 . . . . 0.0 109.699 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 m -55.67 -48.76 74.5 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.573 0.349 . . . . 0.0 110.257 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 28.0 ttt -52.95 -54.1 39.95 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.868 0.867 . . . . 0.0 110.23 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.1 mmt -54.96 -49.67 70.81 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.056 -0.403 . . . . 0.0 111.087 176.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.8 m -56.96 -37.24 71.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.288 0.635 . . . . 0.0 110.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.33 -44.37 65.23 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.897 -0.502 . . . . 0.0 111.278 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -63.82 -46.86 83.17 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 122.729 0.411 . . . . 0.0 112.007 -177.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.8 ptm . . . . . 0 C--O 1.252 1.199 0 CA-C-O 116.792 -1.575 . . . . 0.0 112.328 -171.984 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 120.715 0.293 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 43.4 t -72.55 86.72 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 121.322 0.582 . . . . 0.0 109.803 -169.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.76 -63.43 3.77 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.3 mt -72.35 85.66 1.1 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 169.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.0 p -63.87 168.93 4.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.89 0.876 . . . . 0.0 109.48 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -59.46 -39.64 84.29 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 173.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -52.99 -55.22 25.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.765 1.226 . . . . 0.0 110.69 169.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -56.53 -49.13 75.68 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.447 -0.783 . . . . 0.0 110.702 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -59.11 -40.08 84.24 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.263 0.483 . . . . 0.0 111.616 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.78 -55.83 27.72 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.561 0.619 . . . . 0.0 110.6 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -53.76 -48.58 69.59 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.735 0.302 . . . . 0.0 110.847 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 86.1 mt -58.96 -47.54 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 123.915 0.886 . . . . 0.0 110.334 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -58.88 -51.78 68.55 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.145 0.578 . . . . 0.0 110.59 177.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -56.19 -51.54 67.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.054 0.542 . . . . 0.0 110.304 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.33 -51.03 69.75 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 110.814 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -50.18 -58.65 5.13 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.987 0.915 . . . . 0.0 109.706 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -52.81 -51.35 61.17 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.812 0.845 . . . . 0.0 110.252 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tt -56.18 -52.81 63.04 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.114 0.166 . . . . 0.0 111.055 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -60.17 -40.65 90.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.814 0.34 . . . . 0.0 110.706 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -77.28 40.21 0.27 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.651 1.18 . . . . 0.0 112.552 -171.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.4 p -43.93 -67.3 0.29 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.761 1.624 . . . . 0.0 111.653 -174.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -92.13 -25.23 18.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.092 -171.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -70.32 -39.4 70.77 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 177.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m 41.6 58.82 2.63 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.342 1.457 . . . . 0.0 112.594 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.87 -53.07 0.44 Allowed Glycine 0 CA--C 1.523 0.59 0 N-CA-C 108.71 -1.756 . . . . 0.0 108.71 -175.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.1 p -137.74 130.89 30.48 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.319 0.648 . . . . 0.0 109.684 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.9 mt -73.76 112.2 10.04 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.42 146.83 50.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.057 0.39 . . . . 0.0 110.037 172.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.91 -48.0 0.73 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.043 0.937 . . . . 0.0 113.067 172.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -58.78 -46.75 86.82 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.176 0.59 . . . . 0.0 111.441 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.94 -39.76 93.21 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.862 -0.523 . . . . 0.0 109.644 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.51 -43.21 99.37 Favored 'General case' 0 CA--C 1.532 0.262 0 O-C-N 121.82 -0.55 . . . . 0.0 110.518 174.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -58.2 -48.19 81.11 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.459 -0.775 . . . . 0.0 110.478 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.35 -48.47 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 122.183 -0.323 . . . . 0.0 110.294 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -50.39 66.62 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.678 0.391 . . . . 0.0 110.635 177.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.4 mtm -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.437 0.695 . . . . 0.0 111.359 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -57.37 -46.74 83.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.893 0.77 . . . . 0.0 111.087 171.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.41 -38.23 76.98 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.754 -0.591 . . . . 0.0 111.479 175.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.2 mt -73.16 0.01 12.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.471 1.108 . . . . 0.0 112.456 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.3 71.95 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.184 0.897 . . . . 0.0 113.021 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -76.78 160.37 29.35 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.042 0.921 . . . . 0.0 109.755 177.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -107.18 108.31 61.71 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 169.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -56.3 76.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.445 3.43 . . . . 0.0 115.201 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.7 mmmm -65.7 80.38 0.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.958 1.303 . . . . 0.0 108.855 169.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -31.86 -52.51 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.208 2.203 . . . . 0.0 115.07 -170.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -63.33 -45.37 91.59 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.519 -0.738 . . . . 0.0 111.379 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.76 -43.57 88.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.7 mm -55.76 -48.29 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.055 0.542 . . . . 0.0 109.897 174.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -49.79 76.46 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.799 -0.563 . . . . 0.0 110.87 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -54.91 -56.04 23.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.802 0.273 . . . . 0.0 110.532 177.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.6 ttt -47.7 -62.46 1.44 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.183 1.393 . . . . 0.0 110.187 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.72 -49.05 26.95 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 123.088 0.555 . . . . 0.0 109.62 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -58.61 -49.85 75.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.552 0.615 . . . . 0.0 111.601 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -56.81 -44.65 82.2 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.864 0.466 . . . . 0.0 111.042 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 mm -71.85 -34.58 51.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 O-C-N 122.325 -0.234 . . . . 0.0 111.011 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -76.86 73.24 3.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.776 0.83 . . . . 0.0 110.263 -175.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -56.39 -45.71 80.46 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.522 0.729 . . . . 0.0 111.136 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -145.71 -27.04 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.331 1.052 . . . . 0.0 113.107 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.05 -11.75 6.48 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 115.925 1.13 . . . . 0.0 115.925 -173.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.2 m 49.67 70.01 0.54 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.706 1.602 . . . . 0.0 113.175 169.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.09 -23.21 25.24 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -108.66 159.98 16.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.0 mm -116.99 108.79 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 126.193 1.797 . . . . 0.0 106.742 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -69.09 155.99 39.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.778 0.831 . . . . 0.0 110.139 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -46.33 -47.01 18.55 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.184 0.594 . . . . 0.0 112.155 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -58.48 -43.84 89.14 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.674 0.67 . . . . 0.0 110.779 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.12 -43.14 92.95 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -58.41 -49.0 78.83 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.406 0.622 . . . . 0.0 110.495 176.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.17 -42.47 86.08 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.305 0.642 . . . . 0.0 110.027 175.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 m -56.89 -47.5 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.525 0.602 . . . . 0.0 110.288 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.1 tmm? -55.38 -48.21 74.65 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.101 -0.374 . . . . 0.0 110.664 175.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.3 mmt -57.36 -47.47 81.53 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 122.119 -0.363 . . . . 0.0 110.322 177.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.5 m -57.32 -46.33 83.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.783 0.833 . . . . 0.0 110.269 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.83 -43.08 99.56 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.917 0.487 . . . . 0.0 111.012 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -66.24 -45.56 80.18 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.459 0.303 . . . . 0.0 111.178 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 tpp . . . . . 0 C--O 1.251 1.165 0 CA-C-O 116.946 -1.502 . . . . 0.0 111.095 -175.126 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 m -47.86 118.55 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.305 0.642 . . . . 0.0 109.838 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 128.73 -44.6 1.21 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -169.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 48.6 mt -76.07 86.04 2.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.985 0.514 . . . . 0.0 109.805 177.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 51.7 p -64.69 161.78 17.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.583 0.753 . . . . 0.0 110.575 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -48.59 -41.2 30.03 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.351 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -53.01 -53.6 47.67 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.939 0.896 . . . . 0.0 110.14 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.55 -40.23 93.94 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.52 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -55.41 -46.24 76.63 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.522 0.601 . . . . 0.0 110.561 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -58.63 -50.79 72.55 Favored 'General case' 0 C--O 1.225 -0.19 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -53.76 -48.31 69.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.524 0.33 . . . . 0.0 111.243 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.13 -46.54 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.171 0.588 . . . . 0.0 109.676 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -61.34 -44.59 96.93 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.895 -0.503 . . . . 0.0 111.417 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -56.78 -50.46 72.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.706 -0.621 . . . . 0.0 110.006 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.31 69.16 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.466 0.306 . . . . 0.0 110.575 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -51.28 -57.66 8.26 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.453 0.701 . . . . 0.0 111.078 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -56.74 -46.95 81.05 Favored 'General case' 0 C--O 1.227 -0.095 0 C-N-CA 123.142 0.577 . . . . 0.0 110.674 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.1 tt -56.1 -52.81 62.98 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.497 0.319 . . . . 0.0 110.248 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -60.06 -40.43 89.46 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -72.56 59.97 0.46 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.709 0.404 . . . . 0.0 110.808 170.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.8 p -51.81 -37.99 53.92 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.774 1.23 . . . . 0.0 111.275 176.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -65.98 -22.62 66.48 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.248 0.619 . . . . 0.0 112.241 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.9 34.42 77.09 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -67.55 -20.18 65.38 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.824 0.812 . . . . 0.0 112.09 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.48 1.19 75.03 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.045 1.307 . . . . 0.0 110.375 -169.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 79.0 p -151.77 149.52 29.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.366 2.266 . . . . 0.0 106.498 -171.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.7 mt -86.71 115.76 28.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.95 145.9 55.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.269 0.94 . . . . 0.0 110.651 174.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.6 -50.04 1.13 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.927 0.891 . . . . 0.0 113.069 173.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -54.36 -53.68 50.64 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.693 0.797 . . . . 0.0 110.655 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -58.71 -37.56 76.41 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.628 0.771 . . . . 0.0 110.412 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.1 tp -67.07 -46.61 73.78 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.885 -0.509 . . . . 0.0 110.876 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.283 21.1 pttp -63.65 -36.03 82.5 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.487 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.4 t -57.38 -48.57 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 118.286 0.494 . . . . 0.0 110.502 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.85 -50.66 65.74 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.834 -0.541 . . . . 0.0 110.003 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 19.0 mtm -57.12 -45.77 83.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.68 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -54.19 -50.56 66.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.863 0.756 . . . . 0.0 110.48 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.92 -40.25 75.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.123 -0.361 . . . . 0.0 111.219 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.5 mt -74.25 1.76 10.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.264 1.026 . . . . 0.0 112.798 175.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.95 20.17 65.9 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.181 0.901 . . . . 0.0 113.292 174.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -77.77 163.1 26.43 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.149 0.974 . . . . 0.0 109.506 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -109.02 108.18 60.44 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.79 76.11 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.597 3.531 . . . . 0.0 115.669 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.41 84.01 0.16 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -31.48 -57.87 0.26 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 127.426 2.291 . . . . 0.0 114.067 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.71 -44.74 81.87 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.675 -0.641 . . . . 0.0 111.634 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -71.0 -39.02 72.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.8 mm -54.02 -49.15 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 171.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -58.81 -49.75 76.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.963 -0.541 . . . . 0.0 111.386 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -52.32 -58.16 7.52 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.529 0.604 . . . . 0.0 110.103 177.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.7 ttt -49.03 -60.93 2.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.921 1.288 . . . . 0.0 110.16 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.7 mt -50.48 -49.05 25.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 122.967 0.507 . . . . 0.0 109.71 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.5 m -58.83 -49.27 78.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.333 0.515 . . . . 0.0 111.581 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.04 -45.04 83.48 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.715 0.234 . . . . 0.0 111.203 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.1 mm -72.0 -34.33 50.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 O-C-N 122.034 -0.416 . . . . 0.0 111.02 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -78.42 74.01 4.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.886 0.874 . . . . 0.0 110.404 -174.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.44 -47.31 86.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.061 0.545 . . . . 0.0 111.133 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -134.75 -32.63 0.98 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.484 1.114 . . . . 0.0 112.861 -169.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.82 -8.4 4.23 Favored Glycine 0 CA--C 1.54 1.633 0 N-CA-C 116.421 1.329 . . . . 0.0 116.421 -171.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m 44.88 69.69 0.41 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.051 1.741 . . . . 0.0 113.674 169.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.32 -21.93 41.56 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -112.04 161.42 16.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.8 mm -104.82 123.13 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 124.914 1.285 . . . . 0.0 107.65 173.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -74.79 161.15 29.86 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.756 0.823 . . . . 0.0 110.105 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.08 -46.81 84.83 Favored 'General case' 0 C--O 1.226 -0.155 0 O-C-N 121.955 -0.466 . . . . 0.0 111.573 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -57.91 -46.62 84.69 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.946 0.339 . . . . 0.0 110.951 178.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -58.73 -51.4 70.1 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.073 0.549 . . . . 0.0 109.985 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -54.74 -51.95 64.05 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.51 0.724 . . . . 0.0 110.822 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.58 -48.71 71.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.241 0.617 . . . . 0.0 109.908 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.3 m -56.61 -49.55 74.62 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.403 0.281 . . . . 0.0 110.532 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.6 ttp -54.82 -53.25 57.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.771 0.829 . . . . 0.0 110.62 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 92.5 mmm -58.85 -45.53 89.87 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.137 0.575 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.3 m -58.98 -44.19 91.52 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.879 0.472 . . . . 0.0 110.624 178.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.14 -58.96 5.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -83.14 48.77 1.42 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.192 0.597 . . . . 0.0 110.965 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 15.2 ptp . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.647 -1.168 . . . . 0.0 110.776 176.663 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 61.0 ttm-85 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.537 0.208 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.0 p -156.87 157.11 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 159.43 -58.27 0.33 Allowed Glycine 0 CA--C 1.523 0.563 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 93.5 mt -129.22 85.0 2.27 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.456 1.502 . . . . 0.0 108.503 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 64.7 p -65.6 159.89 23.73 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.034 0.445 . . . . 0.0 110.35 174.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -54.1 -36.84 63.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.106 0.479 . . . . 0.0 110.286 171.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -61.94 -51.45 68.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.528 -0.732 . . . . 0.0 109.682 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -53.47 -47.3 69.91 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.143 0.428 . . . . 0.0 110.712 174.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -55.79 -48.06 76.02 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.554 0.616 . . . . 0.0 111.243 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -56.15 -51.25 68.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.778 0.431 . . . . 0.0 110.883 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -55.13 -51.14 67.38 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.261 0.624 . . . . 0.0 110.8 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.5 mt -58.76 -46.58 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.16 0.584 . . . . 0.0 109.725 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -59.39 -47.39 85.65 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.895 -0.503 . . . . 0.0 110.852 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.33 -53.17 60.52 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.086 0.554 . . . . 0.0 110.271 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.68 -48.94 71.79 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.646 0.378 . . . . 0.0 110.587 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -52.7 -57.62 9.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.936 0.895 . . . . 0.0 110.787 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -56.56 -47.88 78.53 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.413 0.685 . . . . 0.0 110.449 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.35 -53.21 59.05 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.76 0.254 . . . . 0.0 110.365 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -60.82 -38.47 85.52 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.987 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.75 61.9 0.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.62 0.645 . . . . 0.0 109.684 170.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.7 p -52.67 -38.58 60.72 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.768 1.227 . . . . 0.0 111.369 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -66.48 -22.43 66.19 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.31 34.84 81.18 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.326 -0.71 . . . . 0.0 111.326 -175.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 m -67.07 -25.38 66.21 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.593 0.697 . . . . 0.0 111.912 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.6 -20.59 36.57 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.034 1.302 . . . . 0.0 110.547 -169.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.6 p -137.78 147.98 45.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.591 1.956 . . . . 0.0 107.562 -177.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -80.33 122.89 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.81 145.53 52.06 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.061 0.846 . . . . 0.0 110.086 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.18 -46.4 2.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.924 0.89 . . . . 0.0 113.146 175.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -60.72 -46.27 91.07 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.927 -0.483 . . . . 0.0 111.047 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -60.31 -38.9 85.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.8 tp -62.75 -43.4 98.91 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.814 -0.554 . . . . 0.0 110.257 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.2 -47.84 82.19 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.563 -0.711 . . . . 0.0 110.34 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.1 t -55.23 -49.23 74.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 122.246 -0.284 . . . . 0.0 110.325 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.59 -48.9 68.8 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.974 0.509 . . . . 0.0 110.695 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mtm -62.26 -41.4 98.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.295 0.638 . . . . 0.0 111.426 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -57.44 -46.08 83.98 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.807 0.731 . . . . 0.0 110.802 170.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.95 -38.44 79.06 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.597 0.635 . . . . 0.0 111.531 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.0 mt -71.6 -0.44 10.71 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.198 0.999 . . . . 0.0 112.378 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.8 18.87 74.36 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.231 0.92 . . . . 0.0 112.66 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -78.38 160.21 27.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.109 0.954 . . . . 0.0 109.623 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -108.21 107.26 60.02 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -54.95 75.26 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.991 3.794 . . . . 0.0 116.028 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -65.07 85.04 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.495 1.118 . . . . 0.0 108.522 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -31.43 -58.16 0.25 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 127.234 2.214 . . . . 0.0 113.878 -171.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -57.56 -46.15 84.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.707 -0.621 . . . . 0.0 112.12 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -66.08 -43.22 87.97 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.7 mm -54.06 -53.57 27.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 C-N-CA 123.224 0.61 . . . . 0.0 109.796 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -56.34 -52.04 66.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.188 0.595 . . . . 0.0 110.825 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.02 -58.08 8.66 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.64 -54.21 40.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.149 0.98 . . . . 0.0 110.534 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.9 mt -51.08 -50.82 23.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.46 -46.96 85.53 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.482 0.583 . . . . 0.0 111.712 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -57.68 -45.37 85.69 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.855 0.462 . . . . 0.0 110.995 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.24 -34.86 55.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.633 0.254 . . . . 0.0 110.608 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -78.87 76.6 5.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.78 0.832 . . . . 0.0 110.275 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -74.74 -51.66 13.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.12 0.568 . . . . 0.0 110.313 172.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -116.94 -25.9 7.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.789 1.636 . . . . 0.0 112.041 -173.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.84 -20.36 47.77 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.129 0.871 . . . . 0.0 115.056 -169.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m 50.36 58.76 5.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.028 1.331 . . . . 0.0 111.989 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.03 -27.95 16.05 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.633 -0.537 . . . . 0.0 111.951 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.8 p -102.69 175.21 5.57 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 170.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.0 mm -116.09 120.43 64.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 172.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.96 158.41 35.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.478 1.111 . . . . 0.0 110.542 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -48.99 -52.97 21.92 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.075 0.55 . . . . 0.0 111.77 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.8 -38.76 92.28 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 119.006 0.821 . . . . 0.0 111.252 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.5 -49.07 79.03 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.926 -0.483 . . . . 0.0 109.781 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.23 -45.73 83.62 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.578 0.751 . . . . 0.0 110.994 175.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.61 -50.37 68.23 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.773 1.229 . . . . 0.0 108.903 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.7 m -58.4 -48.74 79.68 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.068 0.547 . . . . 0.0 110.404 178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.29 -51.37 64.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.727 0.811 . . . . 0.0 110.187 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.1 mmt -55.68 -53.53 55.42 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 122.288 -0.257 . . . . 0.0 110.68 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 m -51.7 -44.93 63.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.226 0.61 . . . . 0.0 110.692 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.95 -27.7 61.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -79.68 -14.62 58.64 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.87 0.759 . . . . 0.0 112.293 177.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 58.7 mtt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 116.977 -1.487 . . . . 0.0 110.712 -178.041 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.614 0.245 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.9 m -79.63 82.69 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 169.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 58.64 -149.84 36.0 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.16 76.78 2.99 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.355 1.074 . . . . 0.0 109.577 170.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.4 m -63.56 157.67 23.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.531 169.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -43.95 -49.24 8.57 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 123.877 0.871 . . . . 0.0 111.669 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -49.62 -49.77 45.61 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.269 0.628 . . . . 0.0 111.827 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -64.63 -42.89 95.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.76 -0.587 . . . . 0.0 109.981 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -59.91 -39.34 85.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.471 0.578 . . . . 0.0 111.557 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -59.47 -53.94 52.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.508 0.723 . . . . 0.0 109.711 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -53.89 -49.08 69.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 83.6 mt -57.57 -43.51 83.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.125 0.97 . . . . 0.0 109.965 177.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -63.25 -44.56 94.83 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.539 -0.725 . . . . 0.0 111.341 177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -56.67 -50.58 71.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.309 0.504 . . . . 0.0 110.145 175.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.12 -52.26 63.83 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 110.372 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.98 -54.13 16.94 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.879 0.872 . . . . 0.0 110.641 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.5 -51.53 66.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.472 0.709 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -52.8 -53.53 47.05 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.89 -38.16 81.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.887 0.475 . . . . 0.0 111.31 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -73.12 62.48 0.65 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.128 0.422 . . . . 0.0 110.268 174.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 p -57.34 -36.14 70.8 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.973 0.909 . . . . 0.0 111.139 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -66.14 -21.98 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.179 0.592 . . . . 0.0 111.919 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.12 35.09 91.0 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -25.47 62.64 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.772 0.829 . . . . 0.0 111.394 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.83 -24.75 30.85 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.3 p -130.45 138.22 50.19 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.723 1.609 . . . . 0.0 107.546 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.0 mt -79.81 110.92 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.104 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -175.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -60.75 147.22 43.16 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.194 -0.316 . . . . 0.0 110.2 173.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.96 -48.07 1.54 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -59.42 -45.21 92.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.958 0.503 . . . . 0.0 111.29 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -62.22 -38.41 89.08 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.002 -0.436 . . . . 0.0 109.852 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.36 -40.09 93.14 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.653 -0.654 . . . . 0.0 110.91 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -58.45 -47.28 84.52 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.321 -0.862 . . . . 0.0 110.738 171.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.1 t -53.99 -49.11 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 118.433 0.561 . . . . 0.0 109.908 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.66 -56.0 18.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.023 0.529 . . . . 0.0 110.82 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 18.0 mtm -53.45 -49.59 67.07 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.042 0.537 . . . . 0.0 111.264 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.97 -48.04 81.15 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.62 95.51 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.84 0.856 . . . . 0.0 111.247 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.16 -30.76 69.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.579 0.752 . . . . 0.0 110.856 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.14 7.53 10.11 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.627 1.108 . . . . 0.0 112.854 171.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -72.14 167.31 20.54 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.29 1.045 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -105.31 87.16 1.91 Allowed Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.865 1.666 . . . . 0.0 108.706 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.87 73.92 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.543 2.162 . . . . 0.0 112.668 -172.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -64.0 115.25 4.73 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.541 0.737 . . . . 0.0 109.253 172.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -41.51 -47.96 3.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.606 1.562 . . . . 0.0 112.333 -174.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.09 -56.12 16.44 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.62 0.768 . . . . 0.0 110.639 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.07 -44.16 85.3 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.555 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 mm -54.41 -53.83 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.54 0.736 . . . . 0.0 110.4 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -54.8 -52.32 63.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.966 0.507 . . . . 0.0 110.414 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -55.24 -59.98 4.03 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 122.907 0.129 . . . . 0.0 110.693 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.3 ttp -53.89 -54.83 33.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.223 0.609 . . . . 0.0 110.568 -176.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.4 mt -55.45 -50.22 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.25 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -57.86 -44.16 86.41 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.359 0.982 . . . . 0.0 111.89 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.97 -47.32 81.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.67 0.214 . . . . 0.0 110.818 177.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 31.9 mm -74.75 -35.28 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 122.136 -0.352 . . . . 0.0 111.625 -177.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -80.03 46.41 0.8 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.308 1.443 . . . . 0.0 111.909 -169.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.69 -50.71 70.08 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.599 -0.688 . . . . 0.0 110.5 -173.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.44 -31.68 11.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.48 1.512 . . . . 0.0 110.128 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -52.8 -26.14 24.74 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.918 1.723 . . . . 0.0 115.34 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.3 m 50.09 58.7 5.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.051 0.94 . . . . 0.0 111.934 172.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.12 -24.27 27.62 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 124.559 1.076 . . . . 0.0 112.265 -177.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p -125.71 122.8 37.35 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.003 0.902 . . . . 0.0 112.022 -173.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.1 mm -75.32 106.45 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.82 158.72 34.95 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.324 0.583 . . . . 0.0 109.846 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -47.74 -40.12 19.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.013 0.925 . . . . 0.0 112.573 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.65 -47.26 79.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.449 1.022 . . . . 0.0 111.727 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.97 -48.12 80.9 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.521 -0.737 . . . . 0.0 110.136 174.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -55.71 -50.68 69.69 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.09 0.471 . . . . 0.0 110.632 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.2 tp -54.18 -49.1 70.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.864 1.665 . . . . 0.0 109.935 175.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.9 m -57.77 -51.31 70.07 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.893 -0.504 . . . . 0.0 110.527 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 59.8 ttp -55.31 -50.07 70.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.941 0.496 . . . . 0.0 109.869 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -46.72 81.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.19 0.596 . . . . 0.0 110.32 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.4 m -55.3 -52.07 64.66 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.925 0.49 . . . . 0.0 109.922 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -42.48 89.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.456 0.303 . . . . 0.0 111.348 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -68.12 -40.31 82.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.641 0.776 . . . . 0.0 111.431 -178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 C--O 1.251 1.184 0 C-N-CA 124.961 1.304 . . . . 0.0 109.475 -177.362 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.391 0.139 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.77 65.71 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.462 1.105 . . . . 0.0 111.545 -177.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 157.15 -76.59 0.2 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.317 -2.313 . . . . 0.0 107.317 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 77.4 mt -73.97 77.11 1.68 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 170.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.7 p -65.72 166.11 11.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -53.96 -42.97 69.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 171.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -56.21 -49.13 74.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.915 0.486 . . . . 0.0 110.605 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -56.01 -48.97 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.704 0.684 . . . . 0.0 111.139 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -55.73 -44.18 77.3 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.287 0.494 . . . . 0.0 111.238 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -57.68 -52.87 63.67 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.777 0.831 . . . . 0.0 109.791 176.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -56.64 -47.06 80.57 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.983 -0.448 . . . . 0.0 111.314 178.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.59 -46.28 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.307 0.643 . . . . 0.0 109.731 176.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -61.84 -46.45 89.4 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.765 -0.584 . . . . 0.0 111.16 178.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -55.57 -51.44 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.865 -0.522 . . . . 0.0 110.32 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.88 67.75 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.978 0.511 . . . . 0.0 110.433 177.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -49.42 -62.58 1.47 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.126 0.571 . . . . 0.0 110.196 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -52.86 -46.2 67.74 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.472 0.709 . . . . 0.0 111.073 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 tt -56.68 -53.2 60.41 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.676 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -62.29 -37.8 86.89 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.267 0.485 . . . . 0.0 110.979 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -70.91 29.27 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.6 2.36 . . . . 0.0 113.307 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.1 p -39.01 -62.06 0.68 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 127.168 2.187 . . . . 0.0 112.051 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.74 -24.04 15.19 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.361 1.464 . . . . 0.0 110.317 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.82 -36.59 41.78 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.737 1.16 . . . . 0.0 111.689 177.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t 39.38 47.83 1.58 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 0.0 113.288 169.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 138.99 -47.99 0.89 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -173.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.0 p -136.45 123.65 21.77 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.418 0.687 . . . . 0.0 109.327 -173.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -72.08 123.9 27.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.83 147.47 41.12 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.41 -49.04 0.7 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.806 1.242 . . . . 0.0 112.8 171.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -54.2 -54.86 34.07 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.059 0.944 . . . . 0.0 110.926 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -57.84 -41.66 82.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.077 0.551 . . . . 0.0 109.84 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 tp -63.78 -46.78 83.67 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.996 -0.44 . . . . 0.0 111.247 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.257 19.9 ptpt -64.2 -36.11 82.99 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.221 -0.924 . . . . 0.0 111.556 177.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.96 -48.42 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.68 0.673 . . . . 0.0 110.105 171.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.2 -54.48 42.86 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.869 0.467 . . . . 0.0 110.493 177.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.8 mtm -53.88 -45.94 71.21 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.953 0.501 . . . . 0.0 111.43 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.24 -49.3 76.48 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.922 -0.486 . . . . 0.0 110.062 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.38 -40.12 77.48 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.784 0.434 . . . . 0.0 111.093 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.98 2.43 5.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.186 0.995 . . . . 0.0 113.027 174.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.59 18.76 65.34 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.185 0.902 . . . . 0.0 113.229 173.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -75.89 167.28 22.16 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.321 1.061 . . . . 0.0 110.092 172.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -109.52 105.85 57.74 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 169.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -56.86 71.67 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 124.887 3.724 . . . . 0.0 115.912 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -68.36 85.34 0.27 Allowed 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 169.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -31.17 -54.39 0.22 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 127.599 2.359 . . . . 0.0 113.629 -173.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -59.73 -48.73 80.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.814 0.446 . . . . 0.0 110.276 -177.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -64.6 -43.34 94.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.323 0.649 . . . . 0.0 109.68 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 mm -54.04 -52.88 32.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 123.182 0.593 . . . . 0.0 109.904 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -57.94 -48.0 81.24 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.215 0.606 . . . . 0.0 110.812 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.31 -54.94 33.49 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 33.8 ttp -56.44 -52.61 64.02 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.352 0.661 . . . . 0.0 110.361 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.5 mt -48.39 -49.57 12.95 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 123.116 0.566 . . . . 0.0 109.646 176.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -59.11 -49.38 78.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.753 -0.165 . . . . 0.0 111.397 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -56.63 -44.31 81.12 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.898 0.317 . . . . 0.0 111.368 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.0 mm -71.52 -34.96 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.692 0.397 . . . . 0.0 110.572 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -79.24 67.95 5.1 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.694 -0.629 . . . . 0.0 110.872 -174.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -49.16 -33.05 11.34 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.342 1.457 . . . . 0.0 113.705 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -87.21 -17.91 31.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.547 0.612 . . . . 0.0 110.47 -177.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.51 86.75 Favored Glycine 0 N--CA 1.441 -1.02 0 C-N-CA 125.571 1.557 . . . . 0.0 114.367 171.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.2 t -79.56 39.56 0.41 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.316 1.558 . . . . 0.0 112.233 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 45.3 29.91 2.67 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.259 1.885 . . . . 0.0 114.657 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.0 p -157.03 161.95 39.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.6 mm -101.21 106.51 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -65.66 154.82 37.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.092 0.557 . . . . 0.0 109.857 169.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -43.73 -52.06 6.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.592 0.757 . . . . 0.0 112.857 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.43 -34.04 77.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.849 0.75 . . . . 0.0 111.297 -177.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -67.95 -42.43 80.96 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.467 -0.77 . . . . 0.0 109.408 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.16 -45.82 90.0 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.058 -0.401 . . . . 0.0 110.446 173.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.13 -47.8 71.49 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.354 1.062 . . . . 0.0 109.025 174.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.1 m -58.2 -49.41 77.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.934 0.494 . . . . 0.0 110.889 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -54.29 -52.71 60.59 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.86 -0.525 . . . . 0.0 110.171 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.97 -49.12 72.19 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.188 0.595 . . . . 0.0 110.044 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 66.1 m -53.71 -48.05 69.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.557 0.743 . . . . 0.0 110.745 176.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.64 -41.81 99.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.626 0.371 . . . . 0.0 111.478 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.6 -44.18 74.89 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 122.692 0.397 . . . . 0.0 111.53 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.976 -1.011 . . . . 0.0 111.053 178.903 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 . . . . . 0 N--CA 1.477 0.881 0 CA-C-O 120.396 0.141 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.7 p -146.38 155.6 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.5 -58.71 3.33 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 -174.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.7 mt -50.88 125.5 13.62 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.15 0.98 . . . . 0.0 110.276 170.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 65.8 p -65.41 160.56 21.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.786 0.434 . . . . 0.0 110.036 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -52.81 -41.86 64.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.913 0.485 . . . . 0.0 109.889 172.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -54.68 -53.59 52.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.147 0.579 . . . . 0.0 110.578 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -56.1 -45.63 79.38 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 122.04 -0.413 . . . . 0.0 110.851 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -55.8 -47.34 77.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.696 0.68 . . . . 0.0 111.112 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -56.19 -51.01 69.59 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.727 0.411 . . . . 0.0 110.277 176.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.7 -51.18 64.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.881 0.31 . . . . 0.0 110.776 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.22 -42.23 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 123.77 0.828 . . . . 0.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -58.98 -51.16 71.25 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.618 0.767 . . . . 0.0 110.167 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.15 -41.15 97.28 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.311 -0.868 . . . . 0.0 111.54 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.6 -51.76 66.06 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.016 -0.428 . . . . 0.0 110.162 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -50.66 -53.77 28.34 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.556 0.742 . . . . 0.0 110.754 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -52.68 -52.92 53.8 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.264 1.026 . . . . 0.0 110.242 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.84 -51.93 65.79 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.284 0.234 . . . . 0.0 110.854 178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -59.78 -39.41 84.8 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.419 -0.175 . . . . 0.0 110.545 -179.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.82 63.83 0.92 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.471 0.709 . . . . 0.0 109.924 172.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 77.5 p -55.46 -26.59 43.15 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.822 0.849 . . . . 0.0 111.331 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.64 -18.92 64.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.249 1.02 . . . . 0.0 111.411 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.61 21.46 67.01 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 124.308 0.956 . . . . 0.0 113.254 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 p -86.41 -12.54 48.85 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.035 0.917 . . . . 0.0 112.774 -175.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.44 16.57 60.17 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.674 1.13 . . . . 0.0 110.52 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -150.06 121.27 7.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.025 1.33 . . . . 0.0 108.45 -169.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.0 mt -81.56 114.66 22.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.16 148.33 50.23 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.906 0.775 . . . . 0.0 110.307 171.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.88 -47.99 1.1 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.053 0.941 . . . . 0.0 113.142 173.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -58.92 -46.52 87.72 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.148 0.579 . . . . 0.0 111.228 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -61.82 -41.18 97.47 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.74 -45.25 93.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.599 0.636 . . . . 0.0 110.492 176.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -54.93 -50.18 69.48 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.702 -0.624 . . . . 0.0 110.233 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.33 -48.19 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.062 0.392 . . . . 0.0 110.542 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.72 -54.83 32.44 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.197 0.599 . . . . 0.0 110.458 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.6 mtm -56.03 -42.43 76.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.831 0.852 . . . . 0.0 110.992 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -60.56 -45.51 93.61 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.834 -0.541 . . . . 0.0 110.621 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.86 -37.99 84.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.533 0.733 . . . . 0.0 111.138 175.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.0 mt -68.22 -0.42 4.67 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.949 0.899 . . . . 0.0 112.121 171.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.5 13.94 66.82 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.786 1.184 . . . . 0.0 112.399 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -79.46 161.96 25.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.291 1.045 . . . . 0.0 109.825 -176.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -105.45 93.82 7.52 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -68.46 83.87 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.133 1.888 . . . . 0.0 112.353 -173.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -60.07 90.2 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.894 1.278 . . . . 0.0 110.041 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -31.37 -59.55 0.24 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 127.353 2.261 . . . . 0.0 114.051 -170.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.4 -47.68 83.1 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.641 0.655 . . . . 0.0 111.795 -176.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -65.8 -41.41 91.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.3 mm -56.69 -50.84 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 122.794 0.438 . . . . 0.0 110.285 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -60.08 -45.34 93.26 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.441 0.564 . . . . 0.0 111.155 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -53.93 -56.62 16.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.24 0.473 . . . . 0.0 110.282 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.9 ttp -54.42 -53.45 53.99 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.978 0.511 . . . . 0.0 110.81 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.5 mt -49.66 -49.54 19.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 123.512 0.725 . . . . 0.0 109.455 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -59.13 -46.22 88.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.342 0.519 . . . . 0.0 111.522 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.12 -42.95 86.9 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.648 0.379 . . . . 0.0 111.448 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.3 mm -74.79 -34.84 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 122.049 -0.407 . . . . 0.0 111.032 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -78.36 80.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.827 0.851 . . . . 0.0 110.63 -173.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.27 -44.33 15.06 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.556 0.742 . . . . 0.0 110.878 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -118.46 -24.29 6.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.851 1.26 . . . . 0.0 112.241 -175.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.37 -17.15 61.48 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 123.664 0.649 . . . . 0.0 114.611 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.0 t 52.7 58.15 5.65 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.588 1.194 . . . . 0.0 111.932 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.33 -23.03 37.4 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.995 0.807 . . . . 0.0 111.333 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.3 p -110.49 176.55 5.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.321 0.648 . . . . 0.0 109.543 175.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.1 mm -114.79 114.96 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.986 1.714 . . . . 0.0 106.93 169.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.49 160.08 32.1 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.552 1.141 . . . . 0.0 110.534 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -52.73 -52.07 57.82 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.842 0.457 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.69 -44.72 90.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.322 0.51 . . . . 0.0 110.873 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -56.93 -51.01 70.84 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.82 -48.37 78.14 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.165 0.586 . . . . 0.0 111.287 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -58.83 -45.42 90.04 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 121.804 -0.56 . . . . 0.0 110.0 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.9 m -59.21 -52.24 66.53 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 122.083 -0.385 . . . . 0.0 110.292 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 21.2 ttt -49.21 -55.26 13.07 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.911 0.884 . . . . 0.0 109.982 175.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 44.0 tpp -54.85 -50.87 67.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.538 0.735 . . . . 0.0 110.211 -178.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 31.2 m -55.49 -46.32 76.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.091 0.557 . . . . 0.0 110.543 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.6 -42.04 95.82 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.996 0.518 . . . . 0.0 111.816 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -67.7 -45.99 73.54 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.002 0.521 . . . . 0.0 110.927 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 93.9 mtp . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.328 -1.796 . . . . 0.0 111.707 179.541 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 t 59.93 69.32 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 124.108 0.963 . . . . 0.0 109.607 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 77.8 -59.61 3.81 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -71.19 87.46 0.8 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.567 0.747 . . . . 0.0 109.732 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.415 ' H ' ' NE2' ' A' ' 8' ' ' GLN . 41.6 p -63.37 164.73 8.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.87 0.468 . . . . 0.0 109.938 175.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -50.2 -46.91 54.83 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.942 0.497 . . . . 0.0 110.105 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -43.45 -56.29 3.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.165 1.386 . . . . 0.0 111.701 170.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.415 ' NE2' ' H ' ' A' ' 5' ' ' THR . 51.5 mt-30 -65.17 -39.75 93.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 121.962 -0.461 . . . . 0.0 110.158 -177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -60.76 -40.49 92.67 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.647 -0.658 . . . . 0.0 111.088 175.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -57.72 -51.52 69.19 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.787 -0.571 . . . . 0.0 109.838 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.19 -48.11 68.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.064 0.393 . . . . 0.0 111.208 177.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 87.0 mt -57.93 -46.15 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 123.769 0.828 . . . . 0.0 110.042 177.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -60.44 -46.24 90.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.712 0.687 . . . . 0.0 111.014 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -57.69 -52.1 66.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.778 0.431 . . . . 0.0 110.325 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -50.21 69.94 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.746 0.418 . . . . 0.0 110.513 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -51.48 -54.9 22.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.541 0.736 . . . . 0.0 110.722 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -55.22 -49.34 72.22 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.759 0.824 . . . . 0.0 110.562 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 tt -56.06 -52.48 64.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.666 0.212 . . . . 0.0 110.656 178.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -60.13 -42.6 95.16 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.597 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -74.56 64.67 1.21 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.893 0.877 . . . . 0.0 109.735 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.1 p -56.58 -24.45 47.51 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.628 0.771 . . . . 0.0 111.923 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -72.65 -23.28 60.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.258 0.623 . . . . 0.0 111.083 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 -12.8 40.23 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.278 0.942 . . . . 0.0 114.044 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 m -82.63 44.66 0.91 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.839 1.819 . . . . 0.0 113.808 -169.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.55 26.48 15.86 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.548 1.547 . . . . 0.0 114.276 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.8 p -150.09 122.44 8.43 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.03 1.332 . . . . 0.0 109.086 -174.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -80.77 111.08 17.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -63.07 147.62 50.21 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.89 -46.81 1.35 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.507 1.123 . . . . 0.0 113.242 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.4 -48.14 82.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.959 0.504 . . . . 0.0 110.985 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -61.21 -41.52 97.0 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.43 -44.19 95.3 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.939 -0.476 . . . . 0.0 110.299 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -56.42 -49.21 75.2 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.664 -0.648 . . . . 0.0 110.482 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.9 t -54.32 -49.09 66.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.51 -56.46 16.8 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.868 0.467 . . . . 0.0 110.735 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 48.5 mtm -56.05 -44.02 78.44 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.497 0.719 . . . . 0.0 111.487 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -58.11 -51.5 69.45 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.43 78.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.342 0.657 . . . . 0.0 111.474 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -67.55 -10.89 56.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.456 1.103 . . . . 0.0 112.061 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.83 9.41 54.45 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.346 0.974 . . . . 0.0 113.242 172.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -74.15 165.35 25.31 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.7 1.25 . . . . 0.0 109.938 176.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -104.08 92.49 4.59 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.73 77.13 3.09 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 121.786 1.657 . . . . 0.0 112.384 -170.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -60.74 97.42 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.45 1.1 . . . . 0.0 110.124 173.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -31.76 -51.99 0.23 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.691 2.397 . . . . 0.0 113.903 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -58.47 -56.26 24.48 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.089 0.555 . . . . 0.0 111.441 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.71 -42.64 99.75 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.2 mm -58.25 -49.28 82.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 122.976 0.511 . . . . 0.0 110.638 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -57.63 -48.41 79.52 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.393 0.677 . . . . 0.0 109.911 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -53.73 -57.42 10.91 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -54.48 -54.01 46.63 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 110.885 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.5 mt -50.28 -47.26 25.72 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.3 0.64 . . . . 0.0 109.896 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.0 m -62.15 -42.31 99.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.086 0.403 . . . . 0.0 111.604 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.35 -47.11 86.67 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.4 0.546 . . . . 0.0 111.153 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.64 -34.71 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 122.204 -0.31 . . . . 0.0 110.947 -177.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -85.55 92.34 8.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.804 0.841 . . . . 0.0 110.104 -176.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -54.6 -23.02 15.13 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.686 1.195 . . . . 0.0 112.979 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -92.69 -14.3 28.22 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.749 0.82 . . . . 0.0 110.342 -177.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.93 28.44 48.15 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.473 1.511 . . . . 0.0 114.047 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.0 p -90.34 -3.31 57.82 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.463 1.505 . . . . 0.0 112.274 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.86 38.35 19.98 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 -176.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.8 p -140.49 128.68 22.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.529 1.132 . . . . 0.0 109.496 -175.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.4 mm -95.24 108.76 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.67 159.48 34.36 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -51.28 -51.29 55.55 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 121.901 -0.499 . . . . 0.0 111.959 -178.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -53.72 -46.36 70.76 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.933 0.397 . . . . 0.0 111.029 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.48 -47.62 83.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.901 0.48 . . . . 0.0 109.864 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -54.97 -53.2 58.8 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.149 0.58 . . . . 0.0 110.47 176.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -55.18 -47.02 75.79 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.278 0.631 . . . . 0.0 110.001 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.5 m -57.51 -49.73 75.36 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.229 -0.294 . . . . 0.0 110.564 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 53.8 ttp -55.19 -52.75 62.34 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.214 0.606 . . . . 0.0 110.302 178.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 93.6 mmm -53.61 -50.82 64.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.859 0.463 . . . . 0.0 110.134 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.8 m -54.97 -47.14 74.95 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.353 0.661 . . . . 0.0 110.785 178.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.55 94.79 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.127 0.571 . . . . 0.0 111.001 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.35 -49.22 72.52 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.686 0.221 . . . . 0.0 110.925 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.2 ptt? . . . . . 0 C--O 1.249 1.067 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.785 -179.895 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.496 0.189 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.2 t -76.68 70.97 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.06 -68.69 1.08 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -74.55 135.48 42.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.184 0.593 . . . . 0.0 109.664 173.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 m -70.59 148.59 47.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.853 0.861 . . . . 0.0 108.876 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -47.43 -43.99 24.38 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.364 0.665 . . . . 0.0 111.081 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -56.37 -42.94 78.65 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 122.033 -0.417 . . . . 0.0 111.656 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -63.81 -45.36 89.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -55.08 -48.37 73.63 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.093 0.406 . . . . 0.0 110.602 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -55.64 -53.02 61.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.945 0.898 . . . . 0.0 110.139 177.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -53.33 -47.6 69.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 110.945 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.13 -41.86 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.906 -0.496 . . . . 0.0 110.356 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -45.6 92.05 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.562 -0.711 . . . . 0.0 110.172 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -55.87 -52.75 62.98 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.359 -0.838 . . . . 0.0 110.44 176.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.65 -50.47 68.08 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.254 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -50.02 -55.7 13.68 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.322 0.649 . . . . 0.0 110.442 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -54.49 -51.52 64.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 110.629 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.2 -52.09 66.73 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.452 0.168 . . . . 0.0 110.938 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.01 -30.87 71.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.308 -0.245 . . . . 0.0 111.407 -178.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -76.31 47.18 0.45 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.833 1.253 . . . . 0.0 109.586 173.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.56 -43.47 89.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.646 1.579 . . . . 0.0 111.626 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -119.63 -24.43 6.24 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.171 0.988 . . . . 0.0 111.436 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.35 -29.1 59.93 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 123.952 0.787 . . . . 0.0 112.967 -175.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.2 m 49.67 55.78 8.86 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.199 1.399 . . . . 0.0 112.53 169.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 145.19 -51.63 0.6 Allowed Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -177.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -141.96 135.39 29.32 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.44 0.696 . . . . 0.0 109.877 -172.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 81.2 mt -74.35 112.49 11.47 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.081 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -176.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.26 146.13 48.94 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.566 0.621 . . . . 0.0 109.952 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.17 -47.77 1.19 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.758 0.823 . . . . 0.0 112.803 172.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.61 -45.36 89.36 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 111.376 177.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.1 -38.93 93.13 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.964 -0.46 . . . . 0.0 110.032 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.49 -40.23 92.83 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.725 -0.61 . . . . 0.0 110.502 176.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 tmmm? -57.29 -49.07 77.24 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.481 -0.762 . . . . 0.0 110.562 172.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.1 -50.03 47.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 118.62 0.646 . . . . 0.0 110.385 173.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.31 -55.11 27.34 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.525 0.73 . . . . 0.0 110.602 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 68.7 mtm -56.66 -41.4 77.16 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.337 0.655 . . . . 0.0 111.126 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.94 49.94 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 174.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.25 -40.2 81.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.556 0.742 . . . . 0.0 111.447 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.5 mt -68.16 -3.66 11.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.168 0.987 . . . . 0.0 112.312 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.58 24.25 56.62 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 119.372 0.987 . . . . 0.0 112.317 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.24 172.86 11.05 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -118.22 101.52 51.3 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -55.35 73.34 0.03 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 124.578 3.518 . . . . 0.0 116.704 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -68.99 90.73 0.45 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 169.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -31.61 -49.08 0.16 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.327 2.251 . . . . 0.0 113.197 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.41 -58.66 6.34 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.807 0.843 . . . . 0.0 110.758 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -67.16 -42.86 83.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.786 0.834 . . . . 0.0 109.696 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 12.3 mm -52.2 -56.11 7.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 123.568 0.747 . . . . 0.0 109.652 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.67 -51.36 69.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.342 0.657 . . . . 0.0 110.694 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -53.7 -57.19 11.74 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.806 0.275 . . . . 0.0 110.44 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.93 -53.71 52.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.581 0.752 . . . . 0.0 110.551 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 51.7 mt -50.32 -49.6 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 110.154 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -59.65 -47.28 86.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.031 0.378 . . . . 0.0 111.153 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -57.31 -44.73 84.39 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.6 0.36 . . . . 0.0 111.11 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -71.33 -34.08 52.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 O-C-N 122.196 -0.315 . . . . 0.0 110.885 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -73.63 72.51 1.45 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.028 0.931 . . . . 0.0 110.679 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -59.81 -44.24 94.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.16 0.584 . . . . 0.0 111.066 173.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -142.12 -28.27 0.62 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.943 0.897 . . . . 0.0 113.2 -169.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.21 8.86 Favored Glycine 0 CA--C 1.541 1.674 0 N-CA-C 115.699 1.04 . . . . 0.0 115.699 -173.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.3 m 50.82 70.45 0.52 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.59 1.556 . . . . 0.0 112.912 169.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.37 -27.06 8.94 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -105.43 163.64 12.48 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 117.306 0.553 . . . . 0.0 109.527 169.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.4 mm -120.37 115.31 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.101 1.761 . . . . 0.0 106.709 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -73.51 160.86 31.08 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.315 1.046 . . . . 0.0 110.512 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -49.31 -45.0 44.71 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.328 0.651 . . . . 0.0 111.97 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.5 -46.79 88.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.954 0.797 . . . . 0.0 110.927 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -61.64 -46.8 88.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.92 0.488 . . . . 0.0 109.733 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.06 -48.99 79.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.095 0.558 . . . . 0.0 110.637 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.31 -45.19 76.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.928 0.891 . . . . 0.0 109.918 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.0 m -57.26 -51.67 68.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.873 0.306 . . . . 0.0 110.274 175.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -53.56 -52.13 60.71 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.61 0.364 . . . . 0.0 110.711 177.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.7 mmm -60.61 -41.42 94.75 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.088 0.555 . . . . 0.0 111.014 -179.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 47.5 m -57.92 -45.02 87.19 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.555 -0.716 . . . . 0.0 109.481 173.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.65 59.85 1.2 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.847 0.859 . . . . 0.0 111.361 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.7 mttm 74.48 92.64 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.86 2.064 . . . . 0.0 112.182 176.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 117.077 -1.44 . . . . 0.0 111.564 174.359 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -67.26 -22.12 28.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 123.46 0.704 . . . . 0.0 112.579 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.98 -62.35 4.45 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 68.6 mt -114.15 99.39 7.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.251 1.42 . . . . 0.0 109.591 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.4 p -65.32 163.8 14.79 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.804 -0.56 . . . . 0.0 110.224 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -53.44 -34.92 59.7 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.078 0.551 . . . . 0.0 110.971 170.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -64.26 -51.47 63.4 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.226 -0.921 . . . . 0.0 109.857 176.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -55.3 -45.96 76.24 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.278 -0.264 . . . . 0.0 110.416 175.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.42 -39.61 88.04 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.519 -0.738 . . . . 0.0 111.746 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -58.82 -47.76 83.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.16 0.891 . . . . 0.0 111.025 171.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -57.3 -47.3 81.85 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.998 -0.439 . . . . 0.0 110.657 177.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.51 -43.37 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.029 0.931 . . . . 0.0 109.926 178.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -56.8 -51.92 67.06 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.571 0.623 . . . . 0.0 110.323 172.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -53.85 -53.15 56.47 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.649 0.658 . . . . 0.0 110.876 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -50.84 68.68 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.89 0.476 . . . . 0.0 110.654 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -52.64 -53.21 50.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.895 0.878 . . . . 0.0 110.331 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.0 -51.34 68.09 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.443 1.097 . . . . 0.0 110.526 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.38 -51.75 68.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.441 0.162 . . . . 0.0 110.661 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.18 -37.71 81.04 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.823 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -74.59 57.88 0.76 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.663 0.744 . . . . 0.0 109.156 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -28.44 68.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -178.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -80.23 9.15 6.04 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.332 1.053 . . . . 0.0 112.62 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 48.11 36.84 15.98 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.738 1.161 . . . . 0.0 113.437 173.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.3 m -95.57 3.83 53.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.442 1.097 . . . . 0.0 112.454 -171.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.77 14.7 58.75 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 124.008 0.813 . . . . 0.0 112.073 -174.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.3 p -154.46 134.84 13.34 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.808 -1.923 . . . . 0.0 105.808 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -85.99 105.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 169.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.22 149.35 41.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.07 -48.62 1.23 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.867 1.267 . . . . 0.0 112.881 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -57.86 -48.15 80.64 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.844 0.458 . . . . 0.0 111.033 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.77 -39.24 93.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.878 0.471 . . . . 0.0 110.128 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 tp -63.44 -41.91 98.66 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.818 -0.551 . . . . 0.0 109.869 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -59.37 -47.87 83.78 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.749 -0.594 . . . . 0.0 110.452 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.8 t -51.94 -52.02 25.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.489 0.586 . . . . 0.0 110.153 173.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.38 -53.12 55.68 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 123.246 0.619 . . . . 0.0 110.765 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.43 -40.05 85.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.443 0.697 . . . . 0.0 111.54 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.26 -51.65 68.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 172.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.96 -38.11 75.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.848 -0.533 . . . . 0.0 111.841 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -71.58 -1.58 14.03 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.419 1.088 . . . . 0.0 112.183 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 73.12 29.82 64.01 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 119.032 0.833 . . . . 0.0 112.009 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -81.55 169.73 16.73 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 117.586 0.693 . . . . 0.0 109.158 173.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 mp0 -110.54 103.42 54.19 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.808 1.243 . . . . 0.0 107.76 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -57.36 74.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.308 3.338 . . . . 0.0 115.874 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -66.15 85.26 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 169.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -31.45 -55.5 0.26 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.048 2.139 . . . . 0.0 114.031 -172.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.2 -49.1 79.13 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.883 -0.51 . . . . 0.0 111.368 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -62.86 -43.68 98.14 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.306 0.642 . . . . 0.0 109.505 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.2 mm -55.44 -53.47 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.46 0.704 . . . . 0.0 109.863 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.8 -50.93 69.15 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.556 0.342 . . . . 0.0 110.951 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -53.67 -55.5 25.47 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.39 -54.19 43.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.569 0.748 . . . . 0.0 110.732 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.8 mt -51.44 -47.29 35.75 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 -48.1 82.97 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.042 0.383 . . . . 0.0 111.298 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.26 -42.73 77.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.67 0.388 . . . . 0.0 111.178 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.8 mm -76.7 -35.17 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-N 118.068 0.395 . . . . 0.0 111.636 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -85.12 92.78 8.47 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.663 -0.648 . . . . 0.0 111.004 -171.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -21.34 53.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.897 1.279 . . . . 0.0 113.571 177.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.17 1.16 30.38 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.067 0.849 . . . . 0.0 111.029 178.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.34 -4.38 0.08 OUTLIER Glycine 0 CA--C 1.535 1.289 0 C-N-CA 126.267 1.889 . . . . 0.0 116.554 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.8 m -85.89 49.41 1.77 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.912 1.856 . . . . 0.0 110.652 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 37.59 44.22 1.25 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 126.833 2.159 . . . . 0.0 114.45 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.2 p -142.33 136.06 29.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.062 0.931 . . . . 0.0 109.589 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.4 mm -102.16 112.38 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -71.5 158.11 36.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.32 0.648 . . . . 0.0 109.924 170.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.54 -48.65 48.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.559 0.743 . . . . 0.0 112.398 177.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.7 -42.83 89.51 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.25 -0.281 . . . . 0.0 110.266 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -64.82 -46.11 83.36 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.839 0.456 . . . . 0.0 110.118 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.86 -52.71 61.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.921 0.888 . . . . 0.0 110.291 176.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.16 -48.0 79.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.172 0.589 . . . . 0.0 110.028 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.9 m -57.64 -46.54 84.03 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.805 -0.559 . . . . 0.0 110.793 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 55.6 ttp -53.16 -42.98 66.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.672 0.789 . . . . 0.0 110.465 177.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 64.2 mtt -68.3 -53.35 24.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.6 m -49.07 -43.57 41.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.448 1.099 . . . . 0.0 111.346 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.38 -36.28 68.69 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.883 0.873 . . . . 0.0 111.956 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.2 mtmm -81.72 -40.91 22.03 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 86.4 mtp . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.665 -1.16 . . . . 0.0 109.995 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.244 0.545 . . . . 0.0 111.615 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.2 m -77.14 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 125.093 1.357 . . . . 0.0 112.87 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.35 65.65 2.36 Favored Glycine 0 CA--C 1.528 0.851 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.3 mt -73.97 74.74 1.68 Allowed 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.212 -0.581 . . . . 0.0 110.921 -178.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 38.3 p -65.35 164.63 13.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.0 mp0 -55.62 -35.81 66.27 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.012 -0.43 . . . . 0.0 109.961 170.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -68.86 -45.09 71.95 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.537 -0.727 . . . . 0.0 109.969 -179.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.24 -49.74 71.23 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.336 0.516 . . . . 0.0 110.135 171.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -57.79 -47.36 82.78 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.908 -0.495 . . . . 0.0 110.898 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.04 -59.5 4.46 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.278 0.631 . . . . 0.0 110.445 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -48.13 -50.55 28.27 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.924 0.89 . . . . 0.0 111.098 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.86 -45.06 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 122.745 0.418 . . . . 0.0 110.2 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -45.91 90.41 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.779 0.718 . . . . 0.0 110.908 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -49.68 76.77 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.545 -0.722 . . . . 0.0 110.469 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.05 -48.1 73.91 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.989 0.423 . . . . 0.0 110.23 176.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -53.33 -53.33 52.57 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.512 0.725 . . . . 0.0 110.651 176.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -54.54 -50.76 67.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.439 1.096 . . . . 0.0 110.078 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.26 -53.02 62.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -61.15 -37.05 81.49 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.065 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -74.41 60.66 0.87 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.41 0.684 . . . . 0.0 109.925 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 76.4 p -53.8 -34.16 58.29 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.202 1.001 . . . . 0.0 110.819 173.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -75.02 5.32 5.33 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.857 0.863 . . . . 0.0 112.836 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 48.19 34.21 12.15 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.784 1.183 . . . . 0.0 113.475 173.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.6 m -93.49 9.01 38.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.602 0.761 . . . . 0.0 112.434 -170.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.98 18.92 35.47 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.493 1.044 . . . . 0.0 111.926 -170.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.9 p -158.76 136.63 10.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.032 -1.84 . . . . 0.0 106.032 -169.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 88.4 mt -88.12 114.98 27.58 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 174.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -62.88 146.15 53.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.644 1.111 . . . . 0.0 109.777 173.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.95 -45.48 1.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.04 0.836 . . . . 0.0 113.022 173.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.46 -46.62 88.25 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.821 -0.549 . . . . 0.0 111.165 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.01 -38.59 86.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.934 -0.479 . . . . 0.0 110.13 176.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.14 -43.2 99.35 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.809 -0.557 . . . . 0.0 110.277 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -58.54 -46.22 87.29 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.563 -0.71 . . . . 0.0 110.644 176.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.33 -45.86 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 O-C-N 122.051 -0.406 . . . . 0.0 110.498 173.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.14 -52.55 62.92 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.775 -0.578 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.02 -42.2 89.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.54 0.736 . . . . 0.0 111.347 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -55.31 -49.76 71.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.866 -0.521 . . . . 0.0 110.335 172.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.8 -38.72 86.31 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.142 0.577 . . . . 0.0 111.34 178.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 mt -68.87 -2.47 9.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.292 1.037 . . . . 0.0 112.052 173.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.4 25.49 70.36 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 119.019 0.827 . . . . 0.0 111.978 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.67 165.55 21.9 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -107.11 106.95 59.69 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 169.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -58.87 73.66 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.865 3.044 . . . . 0.0 115.096 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.96 96.3 0.59 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.492 -0.755 . . . . 0.0 109.013 173.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -31.2 -60.31 0.21 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 127.543 2.337 . . . . 0.0 114.081 -172.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -58.02 -54.76 43.25 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.09 -41.76 93.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.695 0.798 . . . . 0.0 110.447 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.8 mm -56.33 -55.61 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.135 0.574 . . . . 0.0 109.938 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -57.7 -46.02 84.91 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 122.379 -0.2 . . . . 0.0 110.84 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -55.19 -57.84 10.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.819 0.448 . . . . 0.0 109.903 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.4 ttp -54.41 -53.6 51.98 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.296 0.638 . . . . 0.0 110.233 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.33 -50.29 28.16 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.59 -44.09 89.72 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.819 0.736 . . . . 0.0 111.913 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -59.52 -39.97 85.62 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.953 -0.467 . . . . 0.0 111.386 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -80.72 -34.56 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 118.136 0.425 . . . . 0.0 111.743 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -85.86 87.61 7.44 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.163 0.985 . . . . 0.0 110.903 -169.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -91.19 -47.73 7.35 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.889 0.876 . . . . 0.0 110.586 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -109.21 -28.93 8.75 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.672 1.189 . . . . 0.0 111.286 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -56.36 -27.16 52.76 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.287 0.946 . . . . 0.0 114.582 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.8 m 50.54 58.22 5.75 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.944 1.298 . . . . 0.0 112.301 171.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 98.66 -21.38 46.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.6 p -108.03 -179.88 4.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 169.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.7 mm -122.14 119.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -74.96 158.83 32.63 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.087 0.955 . . . . 0.0 110.208 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -50.82 -47.57 60.04 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.614 0.366 . . . . 0.0 111.703 178.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.09 -45.29 87.44 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.128 0.49 . . . . 0.0 110.535 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -62.77 -46.49 87.76 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.976 0.51 . . . . 0.0 110.017 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -58.37 -48.71 79.72 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.94 0.496 . . . . 0.0 110.671 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.61 -49.05 73.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.691 0.796 . . . . 0.0 109.743 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.9 m -55.98 -49.74 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 117.957 0.344 . . . . 0.0 110.499 178.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.4 ttp -54.32 -53.86 48.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.01 0.524 . . . . 0.0 110.498 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.1 mmt -57.59 -47.95 80.71 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.523 -0.177 . . . . 0.0 110.523 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.1 m -53.59 -47.14 70.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.461 0.704 . . . . 0.0 110.345 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.61 -49.6 77.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.27 -0.269 . . . . 0.0 110.782 177.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -65.26 -51.67 59.31 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -175.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.6 mtm . . . . . 0 C--O 1.251 1.134 0 CA-C-O 117.322 -1.323 . . . . 0.0 111.939 -169.875 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 50.6 ptt85 . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 119.891 -0.1 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 t 67.88 -67.26 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.818 1.647 . . . . 0.0 111.064 179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.7 45.98 94.79 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.514 0.578 . . . . 0.0 112.162 175.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -121.29 89.47 3.13 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.969 1.308 . . . . 0.0 108.587 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.1 p -65.49 160.29 22.55 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 121.961 -0.462 . . . . 0.0 110.09 173.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -54.44 -42.12 70.22 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 172.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -52.67 -55.3 23.54 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.797 0.839 . . . . 0.0 109.858 175.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -53.86 -50.49 66.15 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 119.117 -0.468 . . . . 0.0 110.843 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.86 -47.61 73.98 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.738 0.699 . . . . 0.0 111.268 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -57.95 -50.32 73.76 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.008 0.523 . . . . 0.0 110.855 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -58.5 -47.28 84.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.111 0.414 . . . . 0.0 111.118 178.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.77 -41.59 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -62.41 -47.48 83.92 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.64 -0.663 . . . . 0.0 110.948 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -53.97 -53.47 52.35 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.91 -49.25 69.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.99 0.516 . . . . 0.0 110.466 177.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -52.49 -57.64 9.27 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.354 0.662 . . . . 0.0 110.994 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -56.86 -47.53 80.2 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.943 0.497 . . . . 0.0 110.402 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.8 tt -54.92 -53.74 51.61 Favored 'General case' 0 C--N 1.338 0.074 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -60.01 -37.78 80.75 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.172 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -73.75 61.88 0.78 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.703 0.683 . . . . 0.0 109.601 169.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 57.0 p -53.61 -37.95 63.53 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.664 1.186 . . . . 0.0 111.158 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.15 -22.44 66.37 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.78 0.432 . . . . 0.0 112.079 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.81 34.97 84.17 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 m -67.47 -25.49 65.9 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.588 0.694 . . . . 0.0 111.878 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.73 -27.99 12.27 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.303 1.43 . . . . 0.0 109.74 -169.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -130.76 147.04 52.37 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.914 2.086 . . . . 0.0 108.26 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.92 119.95 27.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.46 144.6 57.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.581 1.082 . . . . 0.0 110.1 173.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.03 -48.79 1.23 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -62.5 -43.51 98.65 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.722 -0.611 . . . . 0.0 110.945 179.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -60.17 -40.32 89.5 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.944 -0.473 . . . . 0.0 109.979 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -63.06 -43.91 97.29 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.786 -0.571 . . . . 0.0 110.223 175.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -57.48 -48.51 79.02 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.479 -0.763 . . . . 0.0 110.744 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.6 t -53.68 -50.58 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.781 0.433 . . . . 0.0 110.327 172.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.58 -53.19 49.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.117 0.567 . . . . 0.0 110.543 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 69.7 mtm -60.18 -42.71 95.58 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.356 0.662 . . . . 0.0 111.188 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -58.38 6.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.14 82.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.908 0.883 . . . . 0.0 112.19 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.94 -16.5 59.47 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.723 1.209 . . . . 0.0 111.76 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.32 24.47 12.49 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 118.637 0.653 . . . . 0.0 112.334 175.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -80.57 176.79 9.48 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -115.39 97.81 49.25 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -60.98 66.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.249 3.299 . . . . 0.0 116.684 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.64 104.99 1.13 Allowed 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.35 -0.844 . . . . 0.0 109.071 171.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -42.49 -46.83 4.94 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.525 1.53 . . . . 0.0 114.139 -170.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -59.72 -57.56 12.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.29 0.496 . . . . 0.0 110.37 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -58.32 -44.97 88.89 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.712 0.805 . . . . 0.0 109.929 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -53.43 -57.83 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.569 0.747 . . . . 0.0 110.18 175.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -57.72 -47.3 82.79 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.067 0.394 . . . . 0.0 111.097 -178.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -55.12 -58.2 8.65 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 52.7 ttp -56.1 -52.24 65.03 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.842 0.457 . . . . 0.0 110.567 -178.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 39.3 mt -49.79 -51.18 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.1 m -57.53 -49.72 75.42 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.173 0.442 . . . . 0.0 111.477 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -56.88 -43.53 81.37 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 117.838 0.29 . . . . 0.0 111.467 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 mm -71.59 -34.78 53.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 122.01 -0.431 . . . . 0.0 110.673 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -78.9 71.4 5.36 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.481 0.713 . . . . 0.0 111.682 -169.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -65.91 -46.77 77.1 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.303 0.641 . . . . 0.0 111.845 176.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -119.54 -40.06 2.82 Favored 'General case' 0 C--N 1.338 0.093 0 C-N-CA 125.423 1.489 . . . . 0.0 111.625 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -55.44 -20.07 21.38 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.468 1.033 . . . . 0.0 115.609 -169.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m 48.13 63.64 1.97 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.247 1.419 . . . . 0.0 112.623 170.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 98.85 -30.3 10.03 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -177.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -102.78 175.94 5.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.9 mm -128.33 118.44 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 175.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -77.36 170.01 17.3 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.5 0.667 . . . . 0.0 111.221 177.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.44 -36.25 73.37 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.624 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -69.43 -50.17 48.25 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.439 0.563 . . . . 0.0 109.706 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -54.11 -50.2 67.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.914 0.886 . . . . 0.0 109.92 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -56.53 -54.85 41.09 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.958 0.503 . . . . 0.0 110.747 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.08 -47.24 68.69 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.601 0.76 . . . . 0.0 110.128 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 m -56.23 -52.05 65.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.619 0.368 . . . . 0.0 110.343 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 47.5 ttp -55.2 -56.82 15.64 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.0 mmm -54.25 -45.18 72.32 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.869 0.468 . . . . 0.0 110.28 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 56.3 m -56.58 -52.52 64.52 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 174.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.21 -34.69 68.79 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.04 0.536 . . . . 0.0 112.131 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -64.22 -22.09 66.82 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.39 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-N 119.221 0.919 . . . . 0.0 110.976 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 120.479 0.18 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 m -74.04 45.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.966 1.306 . . . . 0.0 111.581 176.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.44 -68.94 0.25 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.218 0.913 . . . . 0.0 111.854 -173.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 72.9 mt -74.27 141.82 45.3 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.348 1.059 . . . . 0.0 111.978 -173.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 p -69.19 162.76 26.41 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.757 0.823 . . . . 0.0 110.015 169.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -57.55 -41.49 81.07 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 121.688 -0.632 . . . . 0.0 109.666 169.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.6 mp0 -55.18 -52.87 61.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.518 0.727 . . . . 0.0 109.973 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -55.41 -51.1 67.98 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.921 -0.487 . . . . 0.0 111.141 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.33 -41.93 90.25 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.711 0.687 . . . . 0.0 111.646 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -57.89 -53.63 56.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.114 1.366 . . . . 0.0 110.072 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -53.75 -48.7 69.44 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.234 0.614 . . . . 0.0 110.59 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.4 mt -60.35 -42.07 89.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 122.828 0.451 . . . . 0.0 110.276 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -61.35 -45.63 93.58 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.593 0.633 . . . . 0.0 110.851 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -58.04 -50.72 72.45 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.47 0.577 . . . . 0.0 110.672 177.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.55 -52.54 61.75 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -48.08 -60.15 2.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.532 0.733 . . . . 0.0 109.877 175.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -51.31 -49.18 61.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.321 1.048 . . . . 0.0 110.825 -177.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.86 -52.64 64.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.703 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -61.51 -36.37 80.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.172 0.442 . . . . 0.0 111.506 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -72.74 31.68 0.06 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.313 2.245 . . . . 0.0 113.071 -173.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.2 p -42.81 -59.42 1.97 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 127.512 2.325 . . . . 0.0 111.796 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -98.14 -25.59 14.86 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.84 1.256 . . . . 0.0 110.002 175.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.81 -31.42 54.32 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.988 1.28 . . . . 0.0 113.384 -174.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m 38.17 55.85 1.71 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.518 1.527 . . . . 0.0 114.055 169.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 124.77 -41.99 1.61 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.696 1.141 . . . . 0.0 110.825 -174.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 p -135.69 120.96 19.04 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 117.788 0.794 . . . . 0.0 110.239 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.7 mt -72.89 114.12 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.18 147.38 51.07 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.203 0.456 . . . . 0.0 110.216 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.47 -47.85 0.92 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.053 0.941 . . . . 0.0 113.178 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -58.36 -49.26 77.84 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.927 0.491 . . . . 0.0 111.168 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -59.08 -42.75 91.18 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.29 -42.34 99.27 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.966 -0.458 . . . . 0.0 110.902 177.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.02 -47.91 83.9 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.335 -0.853 . . . . 0.0 110.445 176.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.4 t -54.62 -48.62 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 173.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -53.27 55.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.862 0.465 . . . . 0.0 110.584 177.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mtm -57.95 -42.65 85.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.271 0.628 . . . . 0.0 111.599 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -56.57 -52.07 66.2 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.512 0.596 . . . . 0.0 110.116 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.49 75.57 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 122.093 -0.38 . . . . 0.0 111.64 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -72.28 -2.49 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.863 1.265 . . . . 0.0 112.355 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.49 20.94 61.07 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 119.235 0.925 . . . . 0.0 113.362 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -83.36 159.68 21.8 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.259 1.029 . . . . 0.0 109.763 171.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -104.43 98.75 15.2 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 169.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.36 80.47 1.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.357 2.038 . . . . 0.0 112.15 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -59.79 90.54 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.213 1.405 . . . . 0.0 109.518 170.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -32.39 -51.7 0.27 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.058 2.143 . . . . 0.0 115.207 -171.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -60.15 -51.31 70.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.822 0.737 . . . . 0.0 110.535 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -62.79 -41.11 99.13 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.0 mm -59.16 -47.86 88.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.936 0.494 . . . . 0.0 110.562 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.67 -48.17 81.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.852 0.751 . . . . 0.0 110.453 177.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -54.7 -58.06 9.01 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -48.35 -59.61 3.32 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.421 1.488 . . . . 0.0 110.713 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.7 mt -51.38 -49.27 32.2 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 C-N-CA 123.472 0.709 . . . . 0.0 109.907 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.2 m -60.06 -47.1 87.28 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.582 0.628 . . . . 0.0 111.592 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.8 -45.49 85.99 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.483 0.313 . . . . 0.0 110.885 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.0 mm -71.65 -35.6 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 111.168 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -82.2 75.25 9.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.54 -0.725 . . . . 0.0 110.507 -170.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -58.22 -15.33 9.56 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 0.0 113.11 172.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -91.08 -13.9 32.27 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.773 1.229 . . . . 0.0 110.214 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.48 35.99 45.88 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 126.259 1.885 . . . . 0.0 114.219 175.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -100.53 -7.82 23.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.814 1.246 . . . . 0.0 112.499 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.21 21.25 67.95 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -169.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p -136.1 150.01 48.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.93 0.892 . . . . 0.0 108.931 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.3 mm -109.11 110.24 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 125.006 1.322 . . . . 0.0 108.102 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.21 152.09 45.58 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 171.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.7 -44.77 13.81 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -59.5 -46.8 87.8 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.489 0.586 . . . . 0.0 110.921 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -62.84 -45.95 90.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.019 0.528 . . . . 0.0 109.731 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -56.48 -50.81 70.65 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 123.7 0.8 . . . . 0.0 110.628 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.98 -46.91 84.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.723 0.809 . . . . 0.0 109.709 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.1 m -56.54 -53.7 54.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 117.832 0.287 . . . . 0.0 110.346 177.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -51.33 -53.96 31.0 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.095 0.958 . . . . 0.0 110.053 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.7 tpt -61.29 -44.11 97.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.024 0.53 . . . . 0.0 110.411 -176.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.0 m -56.65 -50.72 71.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 175.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.42 91.28 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.753 0.421 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.68 -45.34 94.4 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.641 0.776 . . . . 0.0 110.548 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 89.6 mmm . . . . . 0 C--O 1.251 1.133 0 CA-C-O 117.194 -1.384 . . . . 0.0 109.914 179.82 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -75.63 166.01 2.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 70.37 -166.29 50.97 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.2 mt -77.04 95.58 4.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.997 0.427 . . . . 0.0 111.045 -176.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.6 p -65.51 161.03 20.96 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.318 0.647 . . . . 0.0 109.389 169.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -56.06 -37.82 69.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.418 -0.801 . . . . 0.0 110.654 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -56.41 -53.66 54.82 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.169 0.588 . . . . 0.0 110.415 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -55.65 -44.87 77.59 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 175.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -53.59 -43.72 68.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.875 0.47 . . . . 0.0 111.243 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -58.26 -53.23 60.61 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -55.26 -44.35 75.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.543 0.211 . . . . 0.0 111.22 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.47 -45.31 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.016 0.926 . . . . 0.0 109.8 178.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -57.45 -52.47 65.24 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.283 0.492 . . . . 0.0 110.604 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -54.45 -50.84 66.75 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.483 -0.761 . . . . 0.0 111.221 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.8 72.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.195 0.598 . . . . 0.0 110.559 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -52.41 -53.68 41.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.704 0.801 . . . . 0.0 110.311 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -56.49 -50.65 71.16 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.254 0.621 . . . . 0.0 110.211 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.1 tt -57.18 -52.23 66.16 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -60.45 -39.07 86.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.113 0.165 . . . . 0.0 110.595 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -74.25 58.14 0.7 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -31.93 71.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.343 1.057 . . . . 0.0 110.684 -173.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -67.97 -22.39 65.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 112.383 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.26 36.13 51.25 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -77.94 1.66 19.94 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.453 1.101 . . . . 0.0 113.136 177.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.95 11.01 42.43 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.538 1.542 . . . . 0.0 112.427 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.1 p -158.18 143.65 16.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 -169.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.7 mt -87.89 110.81 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.07 147.28 44.33 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.459 1.027 . . . . 0.0 110.324 175.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.43 -48.54 1.96 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.907 0.776 . . . . 0.0 113.037 173.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -59.3 -45.93 89.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.836 0.454 . . . . 0.0 110.996 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.22 -36.59 82.44 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.992 -0.442 . . . . 0.0 110.517 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.89 -41.89 90.97 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.651 -0.655 . . . . 0.0 110.069 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -57.89 -49.45 76.67 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.738 -0.601 . . . . 0.0 110.294 173.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 38.5 t -51.98 -51.37 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.066 0.394 . . . . 0.0 110.16 173.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -55.9 21.97 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.721 0.808 . . . . 0.0 110.743 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.6 mtm -54.84 -45.72 74.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.36 0.664 . . . . 0.0 110.99 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -58.22 -48.01 81.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.756 -0.59 . . . . 0.0 110.444 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.16 79.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.978 0.511 . . . . 0.0 111.35 176.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -70.1 -0.47 7.77 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.532 1.133 . . . . 0.0 112.222 174.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.81 16.76 62.87 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-N 119.117 0.872 . . . . 0.0 112.771 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -75.93 162.05 28.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.267 1.033 . . . . 0.0 109.436 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -108.19 105.77 57.21 Favored Pre-proline 0 N--CA 1.449 -0.506 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -56.13 78.5 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.312 3.341 . . . . 0.0 115.253 -178.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.35 81.37 0.09 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.161 0.984 . . . . 0.0 108.933 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -31.72 -56.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 127.329 2.252 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.98 -50.89 67.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.971 0.415 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.65 -40.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.07 0.548 . . . . 0.0 109.692 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.1 mm -53.64 -54.78 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -56.09 -52.67 63.46 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.673 0.789 . . . . 0.0 109.775 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -52.44 -57.86 8.54 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.897 0.479 . . . . 0.0 110.308 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -51.76 -54.46 28.34 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.8 0.84 . . . . 0.0 110.582 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.4 mt -51.61 -49.67 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -57.06 -48.1 79.37 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.056 0.389 . . . . 0.0 111.419 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -58.96 -42.35 89.68 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.94 0.337 . . . . 0.0 111.094 178.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.06 -31.32 44.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 O-C-N 122.156 -0.34 . . . . 0.0 111.231 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.37 75.74 0.54 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.855 0.862 . . . . 0.0 111.635 -173.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -81.96 -35.92 28.49 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.907 1.683 . . . . 0.0 109.848 171.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -152.54 31.18 0.52 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.66 1.584 . . . . 0.0 109.316 -172.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.5 -37.64 3.46 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.205 0.907 . . . . 0.0 111.757 -170.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.6 p 45.08 56.75 5.2 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.857 1.263 . . . . 0.0 111.49 -176.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.26 -10.63 68.17 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-O 119.462 -0.632 . . . . 0.0 113.252 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 p -113.99 171.8 7.38 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.138 0.969 . . . . 0.0 108.815 169.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.6 mm -112.05 116.22 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 169.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.96 156.54 39.49 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.429 0.692 . . . . 0.0 109.783 174.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -51.99 -43.45 63.62 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.904 -0.497 . . . . 0.0 111.728 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -57.45 -46.38 83.68 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.354 0.524 . . . . 0.0 110.66 178.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.15 -47.42 82.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.753 0.421 . . . . 0.0 110.113 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -57.02 -51.71 68.16 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.691 0.758 . . . . 0.0 110.304 178.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.2 tp -52.87 -46.27 67.8 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.957 0.903 . . . . 0.0 110.044 174.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 59.2 m -58.3 -47.85 82.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.319 0.509 . . . . 0.0 111.192 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 77.5 mtp -53.26 -51.29 62.71 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.695 0.679 . . . . 0.0 109.827 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.59 -41.28 94.38 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.862 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.8 m -60.93 -44.63 96.94 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.223 0.609 . . . . 0.0 109.981 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.19 93.18 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.512 0.325 . . . . 0.0 110.519 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.77 -42.34 90.98 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 176.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 67.3 mtm . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.266 -1.349 . . . . 0.0 110.705 -178.155 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.507 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -45.37 -45.51 12.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.907 0.883 . . . . 0.0 111.863 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -55.95 -47.44 77.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.908 0.483 . . . . 0.0 110.834 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -61.99 -43.97 97.71 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.24 -44.11 92.35 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.233 -0.292 . . . . 0.0 110.849 178.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -57.86 -51.78 68.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.209 0.604 . . . . 0.0 110.006 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -52.96 -50.23 64.51 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.128 0.422 . . . . 0.0 111.058 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.76 -46.09 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 124.023 0.929 . . . . 0.0 110.377 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -61.17 -49.18 78.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.796 -0.565 . . . . 0.0 111.067 177.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -55.83 -52.27 64.58 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.568 -0.708 . . . . 0.0 110.569 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.82 75.25 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.389 0.676 . . . . 0.0 110.554 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.8 -55.52 22.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.553 0.741 . . . . 0.0 110.225 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.64 -50.24 70.73 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.856 0.463 . . . . 0.0 110.24 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 tt -55.8 -53.5 55.89 Favored 'General case' 0 N--CA 1.457 -0.099 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -59.91 -36.86 77.88 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 119.49 -0.29 . . . . 0.0 110.941 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -73.83 60.85 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.458 0.572 . . . . 0.0 109.992 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 p . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.481 1.113 . . . . 0.0 111.175 178.078 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.983 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -138.27 144.99 40.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.952 1.701 . . . . 0.0 107.09 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.5 mt -80.82 116.81 25.73 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.062 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -65.98 147.44 53.35 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.11 0.868 . . . . 0.0 110.3 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.76 -46.76 1.3 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.782 0.833 . . . . 0.0 113.213 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.02 -46.41 89.58 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.806 -0.559 . . . . 0.0 111.233 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.51 -38.81 88.72 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.014 -0.429 . . . . 0.0 109.904 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.8 -43.49 98.66 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.843 -0.536 . . . . 0.0 110.389 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -57.02 -48.75 77.75 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.474 -0.766 . . . . 0.0 110.096 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -55.05 -48.03 76.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.731 -0.605 . . . . 0.0 110.551 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.85 70.48 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.873 0.469 . . . . 0.0 110.633 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.3 mtm -61.6 -38.03 86.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.737 -0.602 . . . . 0.0 111.583 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -60.94 -43.41 98.71 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.464 -0.773 . . . . 0.0 111.355 169.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.45 77.09 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.023 0.829 . . . . 0.0 111.331 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.47 -0.62 13.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.088 0.955 . . . . 0.0 112.501 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.66 24.05 68.46 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.406 1.003 . . . . 0.0 112.709 175.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -80.03 165.95 22.03 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.084 0.942 . . . . 0.0 110.525 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -116.19 92.85 37.24 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.737 1.615 . . . . 0.0 107.835 170.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -53.17 140.08 61.63 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.952 3.101 . . . . 0.0 112.98 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -135.95 119.17 16.63 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -40.31 -58.52 1.5 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.289 1.436 . . . . 0.0 114.633 -169.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -51.41 69.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.774 0.43 . . . . 0.0 111.674 -177.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -57.45 -50.69 72.19 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.921 0.488 . . . . 0.0 110.038 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.76 -54.22 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 123.998 0.919 . . . . 0.0 109.786 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -55.44 -50.95 68.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.444 0.697 . . . . 0.0 110.593 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.7 -51.45 67.15 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -177.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.77 -53.29 56.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.222 0.609 . . . . 0.0 110.071 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -50.67 -49.37 25.7 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.783 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -58.64 -44.73 90.16 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.566 1.075 . . . . 0.0 111.471 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -58.67 -47.78 83.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.432 0.293 . . . . 0.0 110.744 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 34.6 mm -71.6 -34.66 53.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 120.716 0.293 . . . . 0.0 110.772 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -81.08 70.45 7.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 109.442 -174.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? . . . . . 0 CA--C 1.534 0.335 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.244 173.691 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.878 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -113.54 166.46 11.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.6 mm -118.54 116.88 52.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 125.622 1.569 . . . . 0.0 107.142 176.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.16 160.6 32.17 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.561 1.144 . . . . 0.0 110.651 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -48.68 -48.72 39.83 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.368 0.667 . . . . 0.0 111.781 176.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -63.93 -40.65 96.94 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.787 0.721 . . . . 0.0 111.356 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -62.77 -47.46 83.39 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.68 -0.638 . . . . 0.0 109.654 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -59.31 -46.63 88.06 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.415 0.686 . . . . 0.0 110.715 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.16 -48.17 74.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.693 1.197 . . . . 0.0 109.509 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.3 m -56.75 -51.09 70.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.288 0.494 . . . . 0.0 110.432 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.7 ttp -51.8 -52.08 51.69 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 176.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 C-N-CA 123.092 0.557 . . . . 0.0 111.077 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.7 p . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.984 0.421 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -50.81 -47.14 60.06 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.43 -52.38 46.67 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.352 0.661 . . . . 0.0 110.677 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -57.45 -48.52 78.96 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.147 -0.346 . . . . 0.0 110.62 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -58.52 -40.49 83.07 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.602 0.637 . . . . 0.0 111.707 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -58.33 -52.66 64.68 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.51 0.724 . . . . 0.0 109.838 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.43 -45.97 87.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.202 -0.311 . . . . 0.0 111.352 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.47 -46.45 82.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.729 0.812 . . . . 0.0 109.597 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -61.64 -44.95 96.01 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.383 0.538 . . . . 0.0 111.013 177.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -55.88 -55.25 34.86 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.456 0.571 . . . . 0.0 110.114 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.77 -49.46 70.83 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.871 0.468 . . . . 0.0 110.03 178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -51.82 -52.68 47.46 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.887 0.475 . . . . 0.0 110.733 177.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.53 -49.17 75.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.755 0.822 . . . . 0.0 110.606 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 tp -53.37 -54.77 31.83 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -61.58 -43.05 99.58 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.456 -0.152 . . . . 0.0 110.909 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.99 62.69 1.15 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.696 1.198 . . . . 0.0 109.547 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 75.0 p . . . . . 0 CA--C 1.534 0.358 0 C-N-CA 124.131 0.972 . . . . 0.0 111.169 173.83 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.096 0 N-CA-C 111.545 -0.622 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.3 p -148.33 121.71 9.05 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.109 1.764 . . . . 0.0 107.536 -169.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.37 110.38 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 169.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.73 148.68 45.97 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.24 -46.24 1.49 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.551 1.14 . . . . 0.0 113.062 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -59.18 -48.03 83.12 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.061 0.457 . . . . 0.0 110.926 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -61.51 -39.69 91.9 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 122.017 -0.427 . . . . 0.0 109.942 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.2 tp -63.56 -42.56 98.34 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.611 -0.681 . . . . 0.0 110.383 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.74 -48.04 80.75 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.687 -0.633 . . . . 0.0 110.168 175.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -54.23 -49.46 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 122.014 -0.429 . . . . 0.0 110.554 173.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.79 -49.08 69.1 Favored 'General case' 0 C--O 1.225 -0.204 0 O-C-N 121.993 -0.442 . . . . 0.0 110.675 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -61.13 -39.88 91.7 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.084 0.554 . . . . 0.0 111.382 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -60.13 -43.35 95.73 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.245 -0.91 . . . . 0.0 111.437 170.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.85 -37.77 77.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.951 0.796 . . . . 0.0 111.346 173.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -72.82 -0.84 14.52 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.042 0.937 . . . . 0.0 112.647 173.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.43 25.67 69.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.318 0.961 . . . . 0.0 112.616 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -82.55 167.06 18.72 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 117.791 0.796 . . . . 0.0 111.035 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -109.35 107.23 59.5 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 169.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -56.87 77.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.638 3.559 . . . . 0.0 114.459 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -65.84 82.5 0.07 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.364 1.066 . . . . 0.0 109.044 170.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -31.29 -55.4 0.24 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 127.817 2.447 . . . . 0.0 114.288 -169.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 mp0 -59.33 -53.27 60.15 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.33 0.586 . . . . 0.0 110.134 -176.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -62.68 -41.66 99.22 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.764 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.99 -52.83 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.095 0.558 . . . . 0.0 109.89 174.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -51.3 70.15 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -53.34 -56.12 19.31 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.483 0.313 . . . . 0.0 110.577 178.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.0 ttp -50.89 -57.92 7.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.303 0.641 . . . . 0.0 110.103 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -51.47 -44.22 32.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 122.724 0.41 . . . . 0.0 110.022 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.2 m -61.75 -49.44 76.41 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.185 0.448 . . . . 0.0 111.558 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -58.09 -45.22 87.53 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.055 0.389 . . . . 0.0 110.848 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.02 -34.21 49.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.241 -0.287 . . . . 0.0 111.101 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -89.46 88.45 7.46 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.65 0.659 . . . . 0.0 110.35 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.539 0.542 0 C-N-CA 123.72 0.808 . . . . 0.0 112.246 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.1 0 CA-C-O 120.075 -0.292 . . . . 0.0 113.059 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.0 p -137.62 124.62 21.43 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.746 1.219 . . . . 0.0 109.602 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.5 mm -91.59 104.34 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.83 151.3 39.37 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -45.41 -47.98 13.64 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.39 -42.35 86.91 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.499 0.591 . . . . 0.0 111.202 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -66.1 -45.38 81.39 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -55.9 -49.94 72.04 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.697 0.399 . . . . 0.0 110.439 174.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -54.28 -49.75 68.89 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 108.902 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.6 m -55.85 -49.68 72.67 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.932 -0.48 . . . . 0.0 111.087 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.7 ttp -54.0 -51.54 63.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.827 -0.545 . . . . 0.0 110.156 177.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 91.4 mmm . . . . . 0 CA--C 1.535 0.373 0 O-C-N 122.026 -0.422 . . . . 0.0 111.559 178.356 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p . . . . . 0 N--CA 1.452 -0.332 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -53.32 -36.07 60.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.166 -0.334 . . . . 0.0 110.112 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.92 -58.12 9.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.948 0.499 . . . . 0.0 110.307 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -52.67 -47.61 67.05 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.86 -0.525 . . . . 0.0 110.685 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -57.61 -44.57 85.56 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.228 -0.295 . . . . 0.0 110.802 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.07 88.11 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.902 -0.499 . . . . 0.0 110.25 177.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -58.13 -48.89 78.83 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 110.225 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -58.58 -41.27 81.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -61.84 -47.7 83.91 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.728 -0.607 . . . . 0.0 111.237 175.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -56.8 -49.31 75.74 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.73 0.695 . . . . 0.0 110.38 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.05 -50.01 67.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.559 0.344 . . . . 0.0 110.736 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -51.77 -57.5 9.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.343 0.657 . . . . 0.0 110.725 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -57.54 -45.71 84.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 110.69 -177.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 tt -56.24 -53.16 60.51 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.0 -37.34 79.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.746 -0.168 . . . . 0.0 110.907 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -73.66 59.82 0.66 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.174 0.443 . . . . 0.0 110.283 170.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 68.2 p . . . . . 0 CA--C 1.533 0.309 0 C-N-CA 124.37 1.068 . . . . 0.0 111.158 176.829 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.979 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p -141.0 145.5 36.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.313 1.845 . . . . 0.0 106.653 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 95.1 mt -82.87 120.08 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.15 146.26 53.59 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.422 1.01 . . . . 0.0 110.426 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.49 -48.33 0.97 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.895 0.878 . . . . 0.0 113.192 173.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.28 -48.27 81.01 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.939 0.496 . . . . 0.0 111.217 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -60.72 -39.51 88.89 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.766 0.426 . . . . 0.0 110.118 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.02 -40.86 99.03 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.869 -0.52 . . . . 0.0 110.549 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -61.07 -47.28 87.09 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.626 -0.671 . . . . 0.0 110.67 174.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -52.86 -50.47 43.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.446 0.566 . . . . 0.0 110.145 173.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.53 -53.65 48.58 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.16 0.584 . . . . 0.0 110.408 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.8 mtm -56.35 -46.1 80.15 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.387 0.675 . . . . 0.0 111.874 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -54.46 -51.02 66.32 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.437 0.562 . . . . 0.0 110.726 172.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.77 73.8 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.966 -0.459 . . . . 0.0 111.763 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.5 mt -74.99 -0.58 19.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.764 1.226 . . . . 0.0 112.258 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.75 25.05 63.41 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 119.189 0.904 . . . . 0.0 112.878 176.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -76.8 166.19 23.68 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.953 0.876 . . . . 0.0 109.259 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -108.77 109.93 61.19 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -58.48 66.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 124.764 3.643 . . . . 0.0 115.94 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.94 90.16 0.43 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 171.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -31.42 -52.28 0.21 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.97 2.108 . . . . 0.0 113.966 -172.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -62.12 -49.11 77.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.341 0.656 . . . . 0.0 110.639 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.68 -47.45 86.2 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.984 0.913 . . . . 0.0 109.307 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.7 mm -54.7 -53.64 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -57.58 -49.39 76.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.615 0.766 . . . . 0.0 110.387 -179.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -54.81 -56.91 14.29 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.453 0.301 . . . . 0.0 110.257 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.3 ttp -51.74 -56.97 10.66 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.793 0.437 . . . . 0.0 110.355 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.51 -50.6 21.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 123.047 0.539 . . . . 0.0 109.631 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.6 m -58.5 -49.07 78.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.312 0.505 . . . . 0.0 111.447 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -56.78 -44.76 82.17 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.85 0.296 . . . . 0.0 111.079 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.3 mm -71.51 -35.09 55.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 121.997 -0.44 . . . . 0.0 111.118 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -80.12 73.92 6.93 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.563 0.745 . . . . 0.0 110.744 -170.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm . . . . . 0 CA--C 1.537 0.449 0 C-N-CA 123.232 0.613 . . . . 0.0 111.727 173.49 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.845 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.6 p -105.95 170.24 8.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -121.46 119.21 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.671 1.588 . . . . 0.0 107.153 177.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.2 157.51 37.6 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.751 0.82 . . . . 0.0 110.479 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -47.14 -50.15 20.91 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 123.515 0.726 . . . . 0.0 112.081 177.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -61.11 -39.81 91.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.41 0.55 . . . . 0.0 111.203 -178.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -66.38 -46.64 75.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.671 0.789 . . . . 0.0 109.75 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -56.4 -46.97 79.91 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.17 0.588 . . . . 0.0 110.331 174.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.68 -45.73 81.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.643 0.777 . . . . 0.0 109.213 176.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.9 m -53.43 -54.24 39.74 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.797 -0.564 . . . . 0.0 110.879 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -53.62 -51.85 61.73 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.081 0.552 . . . . 0.0 110.15 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.452 -0.363 0 C-N-CA 123.279 0.632 . . . . 0.0 110.06 -179.672 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 59.9 p . . . . . 0 N--CA 1.453 -0.314 0 CA-C-O 121.364 0.602 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -55.16 -42.63 73.35 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 169.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.61 -57.45 8.19 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.834 0.854 . . . . 0.0 110.485 173.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -56.0 -49.12 74.51 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.155 -0.34 . . . . 0.0 111.29 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -60.37 -40.88 92.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.173 -179.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -58.37 -52.02 67.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.1 0.409 . . . . 0.0 110.748 172.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -50.78 -49.47 58.2 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.564 0.62 . . . . 0.0 110.595 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.25 -45.08 93.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 122.976 0.51 . . . . 0.0 110.395 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.04 95.8 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 111.885 178.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -44.38 70.82 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 109.951 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.16 -49.38 71.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.898 -0.501 . . . . 0.0 109.854 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -52.42 -51.44 59.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.274 0.63 . . . . 0.0 110.357 175.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -52.87 -53.17 52.89 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.839 0.455 . . . . 0.0 111.211 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -53.88 -53.82 47.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.947 0.499 . . . . 0.0 109.848 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -59.62 -39.19 83.48 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.812 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -73.57 60.61 0.67 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.37 0.532 . . . . 0.0 109.97 171.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.8 p . . . . . 0 CA--C 1.531 0.218 0 C-N-CA 124.945 1.298 . . . . 0.0 111.58 -179.266 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.836 0 N-CA-C 109.851 -1.3 . . . . 0.0 109.851 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.0 p -116.19 142.25 47.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.395 1.478 . . . . 0.0 109.06 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.0 mt -74.36 124.19 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.078 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -71.53 147.07 48.07 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.009 0.822 . . . . 0.0 110.193 172.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.0 -49.4 0.82 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.158 0.983 . . . . 0.0 113.317 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.46 -46.18 87.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.845 -0.534 . . . . 0.0 111.163 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.54 -39.36 93.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.67 0.388 . . . . 0.0 110.192 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.05 -44.3 96.98 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.757 -0.59 . . . . 0.0 110.016 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.54 -46.84 85.99 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.44 -0.787 . . . . 0.0 110.918 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -52.7 -51.9 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 118.3 0.5 . . . . 0.0 110.113 171.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.03 -53.86 43.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.837 0.455 . . . . 0.0 110.594 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.8 mtm -60.47 -41.45 94.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.153 0.581 . . . . 0.0 111.666 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.65 -48.36 79.67 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.22 -37.95 81.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.16 0.584 . . . . 0.0 111.626 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.0 mt -69.5 -1.31 8.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.202 1.001 . . . . 0.0 111.936 173.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.33 8.26 74.95 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.49 1.043 . . . . 0.0 112.504 174.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -73.79 162.63 28.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.557 1.178 . . . . 0.0 109.1 -177.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -104.73 91.76 4.49 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.35 75.48 2.41 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.14 1.893 . . . . 0.0 112.794 -173.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -64.85 123.08 18.45 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.716 0.806 . . . . 0.0 109.736 171.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -42.16 -59.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.83 1.652 . . . . 0.0 113.298 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mp0 -61.26 -49.87 75.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.365 0.602 . . . . 0.0 109.999 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -57.83 -47.27 83.14 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.159 0.984 . . . . 0.0 109.452 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.6 mm -61.97 -46.67 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 122.804 0.441 . . . . 0.0 110.897 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -56.53 -48.73 76.65 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.561 0.618 . . . . 0.0 110.141 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -57.07 -56.31 23.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.41 0.284 . . . . 0.0 110.421 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -49.67 -57.66 6.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.395 1.478 . . . . 0.0 110.995 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.1 mt -51.67 -50.94 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 123.233 0.613 . . . . 0.0 109.66 177.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.7 m -57.87 -46.19 85.24 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.551 0.614 . . . . 0.0 111.825 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -57.23 -46.25 83.14 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 117.841 0.292 . . . . 0.0 110.931 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.72 -34.66 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 122.336 -0.228 . . . . 0.0 111.285 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -77.01 75.91 3.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.331 0.652 . . . . 0.0 111.014 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 123.162 0.585 . . . . 0.0 110.822 173.46 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.884 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 p -102.85 175.67 5.41 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.4 mm -125.52 118.59 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.938 1.695 . . . . 0.0 106.945 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.5 158.88 34.07 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.963 0.905 . . . . 0.0 110.679 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -48.8 -48.18 41.55 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 123.246 0.618 . . . . 0.0 111.551 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -59.85 -48.32 82.15 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.393 0.542 . . . . 0.0 110.877 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.01 -47.25 83.62 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.923 0.489 . . . . 0.0 109.848 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -58.06 -49.38 77.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.324 0.65 . . . . 0.0 111.223 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.39 -47.33 79.17 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.605 0.762 . . . . 0.0 109.041 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.1 m -57.17 -52.16 66.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.897 0.479 . . . . 0.0 110.397 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -52.64 -53.99 39.43 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.979 0.911 . . . . 0.0 110.222 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.451 -0.42 0 C-N-CA 123.829 0.852 . . . . 0.0 109.681 -179.469 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.0 p . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 121.304 0.574 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -52.9 -45.65 67.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 121.768 -0.583 . . . . 0.0 109.947 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.09 -56.84 10.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.681 0.792 . . . . 0.0 110.214 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.55 -44.35 72.8 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 119.563 -0.256 . . . . 0.0 111.056 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -60.79 -39.56 89.35 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.73 0.695 . . . . 0.0 111.834 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -61.81 -49.61 75.64 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.657 0.662 . . . . 0.0 109.42 175.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -53.44 -48.89 68.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.622 0.369 . . . . 0.0 110.459 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -57.49 -44.91 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.937 0.895 . . . . 0.0 110.365 176.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -59.3 -51.65 69.02 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.438 0.563 . . . . 0.0 110.944 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -57.59 -47.38 82.29 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.055 -0.403 . . . . 0.0 110.596 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.94 -52.81 59.44 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.777 0.431 . . . . 0.0 110.306 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.12 -54.84 21.41 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 121.302 0.573 . . . . 0.0 110.469 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.16 -49.77 71.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.984 0.914 . . . . 0.0 110.424 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.03 -53.25 60.23 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.066 0.547 . . . . 0.0 110.502 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -59.5 -34.37 72.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.265 -176.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.04 58.48 0.49 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.516 0.598 . . . . 0.0 110.536 170.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 69.3 p . . . . . 0 CA--C 1.532 0.269 0 C-N-CA 124.58 1.152 . . . . 0.0 110.998 178.123 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.763 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -106.18 145.06 32.0 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.284 1.433 . . . . 0.0 108.561 171.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.3 mt -78.0 121.0 29.84 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.67 146.57 54.64 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.971 0.805 . . . . 0.0 110.427 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.94 -48.93 1.64 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.784 0.834 . . . . 0.0 113.023 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -60.64 -45.14 95.2 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.994 0.518 . . . . 0.0 111.23 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -60.28 -42.45 95.46 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.64 -43.15 99.4 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.566 0.621 . . . . 0.0 110.487 176.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.03 -47.64 84.5 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.553 -0.717 . . . . 0.0 110.864 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.33 -42.42 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 122.895 0.478 . . . . 0.0 110.595 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.84 -54.98 40.77 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.575 -0.703 . . . . 0.0 110.252 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 63.3 mtm -56.46 -47.29 79.5 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.359 0.664 . . . . 0.0 110.736 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -49.81 -55.05 15.63 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.388 0.275 . . . . 0.0 110.591 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.35 81.65 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.615 0.766 . . . . 0.0 111.624 179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.0 mt -66.66 -6.32 15.07 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 112.053 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.28 15.92 45.74 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 118.983 0.811 . . . . 0.0 112.449 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -76.45 165.94 24.11 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.126 0.963 . . . . 0.0 109.437 172.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -113.57 97.9 45.25 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 105.445 -2.057 . . . . 0.0 105.445 169.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -54.47 88.28 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.837 3.025 . . . . 0.0 115.208 -173.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -66.52 82.38 0.1 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.069 0.948 . . . . 0.0 109.828 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -30.96 -58.49 0.22 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.605 2.362 . . . . 0.0 114.44 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -62.29 -51.33 68.1 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.856 -0.528 . . . . 0.0 110.568 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -59.84 -44.73 93.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.521 0.728 . . . . 0.0 110.145 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -53.2 -54.57 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.911 0.884 . . . . 0.0 109.924 175.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -57.61 -48.37 79.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.825 0.45 . . . . 0.0 110.898 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -55.84 -55.18 35.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.696 0.226 . . . . 0.0 110.499 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 48.7 ttp -53.35 -55.26 26.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.29 0.636 . . . . 0.0 110.238 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.3 mt -49.02 -50.54 14.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 123.219 0.608 . . . . 0.0 109.598 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -58.51 -48.31 81.26 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.47 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.88 -42.35 84.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.767 0.427 . . . . 0.0 111.362 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 51.6 mm -74.07 -34.46 38.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 117.966 0.348 . . . . 0.0 111.031 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -76.5 75.45 3.23 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.472 1.109 . . . . 0.0 110.029 -177.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -172.665 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.259 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.7 p -138.74 159.23 42.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.66 0.784 . . . . 0.0 110.396 -173.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.9 mm -111.49 120.38 61.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.358 1.463 . . . . 0.0 108.299 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.37 153.94 35.34 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.31 0.644 . . . . 0.0 110.397 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -50.66 -43.37 57.28 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.346 0.658 . . . . 0.0 112.34 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.9 -45.61 93.93 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.472 0.578 . . . . 0.0 110.759 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -62.14 -46.85 87.15 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -56.41 -50.42 71.67 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.774 0.83 . . . . 0.0 110.877 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.3 tp -57.62 -44.64 85.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.44 0.696 . . . . 0.0 109.995 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.4 m -58.54 -50.07 75.11 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.951 -0.468 . . . . 0.0 110.378 176.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -54.98 -47.0 75.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.838 0.855 . . . . 0.0 110.521 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt . . . . . 0 N--CA 1.454 -0.265 0 O-C-N 122.135 -0.353 . . . . 0.0 110.521 173.23 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.2 p . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -52.18 -45.76 65.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.884 -0.51 . . . . 0.0 110.58 172.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -53.29 -55.69 22.58 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.711 0.805 . . . . 0.0 110.389 176.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -55.05 -44.31 74.59 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.488 -0.292 . . . . 0.0 110.563 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -60.0 -39.25 85.12 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.818 0.735 . . . . 0.0 111.659 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -62.16 -50.27 72.51 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.188 0.903 . . . . 0.0 109.721 176.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -53.48 -49.61 67.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.033 0.445 . . . . 0.0 110.172 177.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.3 mt -60.89 -41.34 88.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.49 1.116 . . . . 0.0 110.435 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.11 -47.14 85.91 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.878 0.763 . . . . 0.0 110.683 175.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -55.95 -54.68 41.82 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.73 -49.23 68.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.165 0.586 . . . . 0.0 110.446 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -52.22 -56.08 17.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.894 0.878 . . . . 0.0 110.702 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -54.5 -49.97 68.92 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 110.583 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -56.39 -53.85 52.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.198 0.199 . . . . 0.0 110.607 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -60.19 -35.17 74.77 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.454 0.302 . . . . 0.0 111.065 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -72.35 58.47 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.218 0.607 . . . . 0.0 110.421 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.2 p . . . . . 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 110.967 177.015 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 N-CA-C 111.915 -0.474 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 42.5 p -156.63 135.32 11.64 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 104.751 -2.315 . . . . 0.0 104.751 -169.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.1 mt -85.07 116.25 28.23 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -63.88 144.24 57.22 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.82 0.737 . . . . 0.0 109.767 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.21 -46.31 1.48 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 174.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -54.99 -52.65 62.43 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.385 0.674 . . . . 0.0 111.019 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -58.19 -38.92 77.66 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.026 0.531 . . . . 0.0 109.912 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.2 tp -65.37 -45.69 83.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.512 0.596 . . . . 0.0 111.551 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.282 20.3 pttp -62.28 -39.4 92.81 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.88 -1.137 . . . . 0.0 111.673 175.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.8 -50.35 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.346 0.521 . . . . 0.0 110.151 171.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -53.03 57.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.875 0.87 . . . . 0.0 110.309 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtm -57.28 -42.21 81.21 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.736 0.414 . . . . 0.0 111.421 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -56.15 18.01 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 172.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.79 -39.12 73.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.197 0.599 . . . . 0.0 112.003 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.1 mt -70.64 -6.79 39.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.53 1.132 . . . . 0.0 112.539 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.4 22.61 36.81 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.456 1.025 . . . . 0.0 112.774 175.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -76.19 -179.2 4.88 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.211 1.005 . . . . 0.0 109.916 174.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.36 102.87 36.04 Favored Pre-proline 0 N--CA 1.452 -0.359 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 169.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -59.96 69.8 0.07 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.021 3.147 . . . . 0.0 115.699 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.49 88.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -32.15 -49.33 0.19 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.0 2.12 . . . . 0.0 115.074 -173.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -60.98 -48.27 82.6 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.571 0.623 . . . . 0.0 111.144 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -68.53 -42.43 78.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.457 0.703 . . . . 0.0 109.577 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mm -52.72 -57.69 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.329 0.651 . . . . 0.0 109.336 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -54.68 -51.05 66.74 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.805 0.842 . . . . 0.0 110.475 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -54.16 -57.92 9.33 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.197 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.3 ttp -56.92 -53.04 62.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.494 0.317 . . . . 0.0 110.254 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.4 mt -50.19 -49.79 21.84 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.299 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.2 m -58.3 -48.39 80.64 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.372 0.533 . . . . 0.0 111.482 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -57.72 -45.07 86.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.424 0.29 . . . . 0.0 111.401 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.4 mm -71.69 -33.62 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 122.206 -0.308 . . . . 0.0 110.832 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -75.81 69.84 2.51 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.03 0.932 . . . . 0.0 110.163 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? . . . . . 0 N--CA 1.445 -0.704 0 C-N-CA 124.586 1.154 . . . . 0.0 110.875 173.712 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.846 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.5 p -106.63 167.71 9.67 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.9 mm -121.04 113.7 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.775 1.63 . . . . 0.0 106.804 173.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -71.56 159.32 34.66 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.402 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -50.94 -43.86 60.25 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.259 0.624 . . . . 0.0 112.03 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.91 -48.52 81.35 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.387 0.54 . . . . 0.0 110.722 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -60.11 -47.44 85.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.852 0.461 . . . . 0.0 109.931 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -56.88 -50.37 72.69 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.755 0.822 . . . . 0.0 110.456 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.64 -44.17 89.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.389 0.676 . . . . 0.0 109.88 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.0 m -56.97 -49.61 75.19 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.907 -0.496 . . . . 0.0 110.221 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 61.2 ttp -52.67 -50.94 62.25 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 C--O 1.224 -0.257 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -178.361 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.9 p . . . . . 0 N--CA 1.453 -0.275 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -55.77 -36.75 67.69 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.745 -0.597 . . . . 0.0 110.519 169.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -68.95 -46.36 68.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.668 -0.645 . . . . 0.0 109.562 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.39 -43.06 88.37 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.457 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.37 -45.78 92.29 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.921 0.782 . . . . 0.0 111.166 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -54.36 -54.3 42.35 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.15 0.432 . . . . 0.0 110.232 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -54.25 -46.78 72.69 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.257 0.623 . . . . 0.0 111.054 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.0 mt -59.59 -45.97 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.307 0.643 . . . . 0.0 110.3 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -60.15 -45.94 91.37 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.653 -0.655 . . . . 0.0 110.879 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -57.19 -51.72 68.2 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.072 0.549 . . . . 0.0 110.323 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -49.39 72.03 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.84 0.456 . . . . 0.0 110.691 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -52.79 -57.17 11.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.48 0.712 . . . . 0.0 110.263 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -52.46 -50.56 62.41 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.241 1.016 . . . . 0.0 110.836 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.23 -54.71 43.73 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -59.86 -33.58 71.99 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.424 -0.172 . . . . 0.0 111.044 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -72.51 51.55 0.26 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.449 1.099 . . . . 0.0 110.796 172.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 66.4 p . . . . . 0 CA--C 1.531 0.228 0 C-N-CA 124.934 1.294 . . . . 0.0 111.618 -176.964 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.12 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.7 p -155.48 120.55 4.84 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -173.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -78.95 122.19 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.67 145.32 48.97 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 174.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.99 -48.24 0.76 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.615 1.166 . . . . 0.0 113.052 172.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.75 -48.62 80.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.021 0.528 . . . . 0.0 111.111 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -59.99 -42.47 94.29 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.027 -0.421 . . . . 0.0 109.888 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -62.64 -40.86 98.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.947 -0.471 . . . . 0.0 110.534 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -60.23 -47.76 84.59 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.6 t -54.55 -48.97 69.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 CA-C-N 118.216 0.462 . . . . 0.0 110.2 173.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.75 -51.17 64.23 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.163 -0.336 . . . . 0.0 110.592 176.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.9 mtm -59.21 -42.09 90.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.377 0.671 . . . . 0.0 111.948 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -57.69 -49.41 76.6 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.516 0.598 . . . . 0.0 110.018 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.95 -39.15 77.39 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.947 -0.471 . . . . 0.0 111.63 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -72.37 -1.88 17.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.528 1.131 . . . . 0.0 112.337 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 27.12 72.11 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-N 119.054 0.843 . . . . 0.0 112.373 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -80.78 164.07 23.01 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -106.05 92.51 6.62 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 107.634 -1.246 . . . . 0.0 107.634 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -75.8 75.84 3.91 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.115 1.876 . . . . 0.0 112.227 -169.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.14 98.68 0.11 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.692 1.197 . . . . 0.0 110.128 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -31.71 -57.09 0.28 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.314 2.245 . . . . 0.0 113.867 -174.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -51.71 -49.88 61.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.234 0.614 . . . . 0.0 111.176 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -70.5 -41.75 72.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 mm -57.0 -46.77 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.141 0.576 . . . . 0.0 110.995 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -55.52 -51.54 66.66 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.297 0.499 . . . . 0.0 110.421 177.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -59.37 -51.42 69.98 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.291 -0.255 . . . . 0.0 110.695 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.8 ttp -50.0 -56.79 9.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.535 0.734 . . . . 0.0 109.974 177.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -50.65 -49.72 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 C-N-CA 123.526 0.73 . . . . 0.0 109.563 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 p -58.56 -47.02 85.63 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.479 0.581 . . . . 0.0 111.219 -178.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -60.56 -43.42 97.28 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.642 0.777 . . . . 0.0 110.903 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.5 mm -71.53 -34.15 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 O-C-N 122.218 -0.301 . . . . 0.0 110.766 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -78.47 67.31 4.22 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.586 -0.696 . . . . 0.0 110.559 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 125.921 1.688 . . . . 0.0 113.028 176.474 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.045 0 CA-C-O 120.046 -0.308 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.4 p -161.32 161.56 30.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -170.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.8 mm -99.88 110.09 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.18 158.07 36.47 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.578 0.751 . . . . 0.0 110.299 170.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.46 -47.74 38.1 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.707 0.803 . . . . 0.0 112.24 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.51 -40.73 95.65 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.356 0.525 . . . . 0.0 110.733 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -65.6 -45.93 81.29 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.32 -47.31 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.65 0.78 . . . . 0.0 111.1 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.1 tp -57.15 -49.02 77.26 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.527 0.731 . . . . 0.0 109.699 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 m -55.67 -48.76 74.5 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.573 0.349 . . . . 0.0 110.257 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 28.0 ttt -52.95 -54.1 39.95 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.868 0.867 . . . . 0.0 110.23 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.1 mmt . . . . . 0 CA--C 1.533 0.324 0 O-C-N 122.056 -0.403 . . . . 0.0 111.087 176.679 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.0 p . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -59.46 -39.64 84.29 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 173.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -52.99 -55.22 25.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.765 1.226 . . . . 0.0 110.69 169.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -56.53 -49.13 75.68 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.447 -0.783 . . . . 0.0 110.702 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -59.11 -40.08 84.24 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.263 0.483 . . . . 0.0 111.616 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.78 -55.83 27.72 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.561 0.619 . . . . 0.0 110.6 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -53.76 -48.58 69.59 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.735 0.302 . . . . 0.0 110.847 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 86.1 mt -58.96 -47.54 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 123.915 0.886 . . . . 0.0 110.334 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -58.88 -51.78 68.55 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.145 0.578 . . . . 0.0 110.59 177.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -56.19 -51.54 67.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.054 0.542 . . . . 0.0 110.304 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.33 -51.03 69.75 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 110.814 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -50.18 -58.65 5.13 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.987 0.915 . . . . 0.0 109.706 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -52.81 -51.35 61.17 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.812 0.845 . . . . 0.0 110.252 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tt -56.18 -52.81 63.04 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.114 0.166 . . . . 0.0 111.055 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -60.17 -40.65 90.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.814 0.34 . . . . 0.0 110.706 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -77.28 40.21 0.27 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.651 1.18 . . . . 0.0 112.552 -171.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.4 p . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 125.761 1.624 . . . . 0.0 111.653 -174.913 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.59 0 N-CA-C 108.71 -1.756 . . . . 0.0 108.71 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.1 p -137.74 130.89 30.48 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.319 0.648 . . . . 0.0 109.684 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.9 mt -73.76 112.2 10.04 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.42 146.83 50.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.057 0.39 . . . . 0.0 110.037 172.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.91 -48.0 0.73 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.043 0.937 . . . . 0.0 113.067 172.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -58.78 -46.75 86.82 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.176 0.59 . . . . 0.0 111.441 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.94 -39.76 93.21 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.862 -0.523 . . . . 0.0 109.644 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.51 -43.21 99.37 Favored 'General case' 0 CA--C 1.532 0.262 0 O-C-N 121.82 -0.55 . . . . 0.0 110.518 174.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -58.2 -48.19 81.11 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.459 -0.775 . . . . 0.0 110.478 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.35 -48.47 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 122.183 -0.323 . . . . 0.0 110.294 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -50.39 66.62 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.678 0.391 . . . . 0.0 110.635 177.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.4 mtm -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.437 0.695 . . . . 0.0 111.359 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -57.37 -46.74 83.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.893 0.77 . . . . 0.0 111.087 171.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.41 -38.23 76.98 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.754 -0.591 . . . . 0.0 111.479 175.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.2 mt -73.16 0.01 12.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.471 1.108 . . . . 0.0 112.456 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.3 71.95 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.184 0.897 . . . . 0.0 113.021 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -76.78 160.37 29.35 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.042 0.921 . . . . 0.0 109.755 177.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -107.18 108.31 61.71 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 169.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -56.3 76.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.445 3.43 . . . . 0.0 115.201 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.7 mmmm -65.7 80.38 0.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.958 1.303 . . . . 0.0 108.855 169.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -31.86 -52.51 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.208 2.203 . . . . 0.0 115.07 -170.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -63.33 -45.37 91.59 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.519 -0.738 . . . . 0.0 111.379 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.76 -43.57 88.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.7 mm -55.76 -48.29 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.055 0.542 . . . . 0.0 109.897 174.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -49.79 76.46 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.799 -0.563 . . . . 0.0 110.87 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -54.91 -56.04 23.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.802 0.273 . . . . 0.0 110.532 177.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.6 ttt -47.7 -62.46 1.44 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.183 1.393 . . . . 0.0 110.187 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.72 -49.05 26.95 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 123.088 0.555 . . . . 0.0 109.62 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -58.61 -49.85 75.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.552 0.615 . . . . 0.0 111.601 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -56.81 -44.65 82.2 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.864 0.466 . . . . 0.0 111.042 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 mm -71.85 -34.58 51.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 O-C-N 122.325 -0.234 . . . . 0.0 111.011 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -76.86 73.24 3.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.776 0.83 . . . . 0.0 110.263 -175.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 123.522 0.729 . . . . 0.0 111.136 174.676 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.92 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -108.66 159.98 16.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.0 mm -116.99 108.79 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 126.193 1.797 . . . . 0.0 106.742 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -69.09 155.99 39.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.778 0.831 . . . . 0.0 110.139 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -46.33 -47.01 18.55 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.184 0.594 . . . . 0.0 112.155 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -58.48 -43.84 89.14 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.674 0.67 . . . . 0.0 110.779 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.12 -43.14 92.95 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -58.41 -49.0 78.83 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.406 0.622 . . . . 0.0 110.495 176.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.17 -42.47 86.08 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.305 0.642 . . . . 0.0 110.027 175.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 m -56.89 -47.5 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.525 0.602 . . . . 0.0 110.288 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.1 tmm? -55.38 -48.21 74.65 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.101 -0.374 . . . . 0.0 110.664 175.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.3 mmt . . . . . 0 CA--C 1.53 0.181 0 O-C-N 122.119 -0.363 . . . . 0.0 110.322 177.892 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 51.7 p . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 121.184 0.516 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -48.59 -41.2 30.03 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.351 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -53.01 -53.6 47.67 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.939 0.896 . . . . 0.0 110.14 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.55 -40.23 93.94 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.52 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -55.41 -46.24 76.63 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.522 0.601 . . . . 0.0 110.561 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -58.63 -50.79 72.55 Favored 'General case' 0 C--O 1.225 -0.19 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -53.76 -48.31 69.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.524 0.33 . . . . 0.0 111.243 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.13 -46.54 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.171 0.588 . . . . 0.0 109.676 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -61.34 -44.59 96.93 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.895 -0.503 . . . . 0.0 111.417 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -56.78 -50.46 72.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.706 -0.621 . . . . 0.0 110.006 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.31 69.16 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.466 0.306 . . . . 0.0 110.575 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -51.28 -57.66 8.26 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.453 0.701 . . . . 0.0 111.078 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -56.74 -46.95 81.05 Favored 'General case' 0 C--O 1.227 -0.095 0 C-N-CA 123.142 0.577 . . . . 0.0 110.674 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.1 tt -56.1 -52.81 62.98 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.497 0.319 . . . . 0.0 110.248 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -60.06 -40.43 89.46 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -72.56 59.97 0.46 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.709 0.404 . . . . 0.0 110.808 170.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.8 p . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 124.774 1.23 . . . . 0.0 111.275 176.103 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.225 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 79.0 p -151.77 149.52 29.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.366 2.266 . . . . 0.0 106.498 -171.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.7 mt -86.71 115.76 28.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.95 145.9 55.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.269 0.94 . . . . 0.0 110.651 174.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.6 -50.04 1.13 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.927 0.891 . . . . 0.0 113.069 173.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -54.36 -53.68 50.64 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.693 0.797 . . . . 0.0 110.655 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -58.71 -37.56 76.41 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.628 0.771 . . . . 0.0 110.412 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.1 tp -67.07 -46.61 73.78 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.885 -0.509 . . . . 0.0 110.876 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.283 21.1 pttp -63.65 -36.03 82.5 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.487 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.4 t -57.38 -48.57 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 118.286 0.494 . . . . 0.0 110.502 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.85 -50.66 65.74 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.834 -0.541 . . . . 0.0 110.003 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 19.0 mtm -57.12 -45.77 83.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.68 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -54.19 -50.56 66.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.863 0.756 . . . . 0.0 110.48 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.92 -40.25 75.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.123 -0.361 . . . . 0.0 111.219 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.5 mt -74.25 1.76 10.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.264 1.026 . . . . 0.0 112.798 175.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.95 20.17 65.9 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.181 0.901 . . . . 0.0 113.292 174.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -77.77 163.1 26.43 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.149 0.974 . . . . 0.0 109.506 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -109.02 108.18 60.44 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.79 76.11 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.597 3.531 . . . . 0.0 115.669 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.41 84.01 0.16 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -31.48 -57.87 0.26 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 127.426 2.291 . . . . 0.0 114.067 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.71 -44.74 81.87 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.675 -0.641 . . . . 0.0 111.634 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -71.0 -39.02 72.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.8 mm -54.02 -49.15 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 171.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -58.81 -49.75 76.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.963 -0.541 . . . . 0.0 111.386 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -52.32 -58.16 7.52 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.529 0.604 . . . . 0.0 110.103 177.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.7 ttt -49.03 -60.93 2.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.921 1.288 . . . . 0.0 110.16 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.7 mt -50.48 -49.05 25.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 122.967 0.507 . . . . 0.0 109.71 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.5 m -58.83 -49.27 78.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.333 0.515 . . . . 0.0 111.581 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.04 -45.04 83.48 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.715 0.234 . . . . 0.0 111.203 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.1 mm -72.0 -34.33 50.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 O-C-N 122.034 -0.416 . . . . 0.0 111.02 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -78.42 74.01 4.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.886 0.874 . . . . 0.0 110.404 -174.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 123.061 0.545 . . . . 0.0 111.133 173.589 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.837 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -112.04 161.42 16.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.8 mm -104.82 123.13 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 124.914 1.285 . . . . 0.0 107.65 173.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -74.79 161.15 29.86 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.756 0.823 . . . . 0.0 110.105 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.08 -46.81 84.83 Favored 'General case' 0 C--O 1.226 -0.155 0 O-C-N 121.955 -0.466 . . . . 0.0 111.573 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -57.91 -46.62 84.69 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.946 0.339 . . . . 0.0 110.951 178.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -58.73 -51.4 70.1 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.073 0.549 . . . . 0.0 109.985 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -54.74 -51.95 64.05 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.51 0.724 . . . . 0.0 110.822 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.58 -48.71 71.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.241 0.617 . . . . 0.0 109.908 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.3 m -56.61 -49.55 74.62 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.403 0.281 . . . . 0.0 110.532 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.6 ttp -54.82 -53.25 57.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.771 0.829 . . . . 0.0 110.62 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 92.5 mmm . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.137 0.575 . . . . 0.0 110.441 179.633 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 64.7 p . . . . . 0 CA--C 1.532 0.282 0 CA-C-O 121.034 0.445 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -54.1 -36.84 63.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.106 0.479 . . . . 0.0 110.286 171.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -61.94 -51.45 68.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.528 -0.732 . . . . 0.0 109.682 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -53.47 -47.3 69.91 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.143 0.428 . . . . 0.0 110.712 174.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -55.79 -48.06 76.02 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.554 0.616 . . . . 0.0 111.243 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -56.15 -51.25 68.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.778 0.431 . . . . 0.0 110.883 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -55.13 -51.14 67.38 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.261 0.624 . . . . 0.0 110.8 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.5 mt -58.76 -46.58 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.16 0.584 . . . . 0.0 109.725 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -59.39 -47.39 85.65 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.895 -0.503 . . . . 0.0 110.852 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.33 -53.17 60.52 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.086 0.554 . . . . 0.0 110.271 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.68 -48.94 71.79 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.646 0.378 . . . . 0.0 110.587 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -52.7 -57.62 9.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.936 0.895 . . . . 0.0 110.787 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -56.56 -47.88 78.53 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.413 0.685 . . . . 0.0 110.449 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.35 -53.21 59.05 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.76 0.254 . . . . 0.0 110.365 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -60.82 -38.47 85.52 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.987 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.75 61.9 0.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.62 0.645 . . . . 0.0 109.684 170.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.7 p . . . . . 0 CA--C 1.532 0.26 0 C-N-CA 124.768 1.227 . . . . 0.0 111.369 179.514 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.056 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.6 p -137.78 147.98 45.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.591 1.956 . . . . 0.0 107.562 -177.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -80.33 122.89 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.81 145.53 52.06 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.061 0.846 . . . . 0.0 110.086 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.18 -46.4 2.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.924 0.89 . . . . 0.0 113.146 175.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -60.72 -46.27 91.07 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.927 -0.483 . . . . 0.0 111.047 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -60.31 -38.9 85.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.8 tp -62.75 -43.4 98.91 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.814 -0.554 . . . . 0.0 110.257 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.2 -47.84 82.19 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.563 -0.711 . . . . 0.0 110.34 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.1 t -55.23 -49.23 74.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 122.246 -0.284 . . . . 0.0 110.325 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.59 -48.9 68.8 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.974 0.509 . . . . 0.0 110.695 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mtm -62.26 -41.4 98.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.295 0.638 . . . . 0.0 111.426 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -57.44 -46.08 83.98 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.807 0.731 . . . . 0.0 110.802 170.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.95 -38.44 79.06 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.597 0.635 . . . . 0.0 111.531 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.0 mt -71.6 -0.44 10.71 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.198 0.999 . . . . 0.0 112.378 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.8 18.87 74.36 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.231 0.92 . . . . 0.0 112.66 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -78.38 160.21 27.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.109 0.954 . . . . 0.0 109.623 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -108.21 107.26 60.02 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -54.95 75.26 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.991 3.794 . . . . 0.0 116.028 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -65.07 85.04 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.495 1.118 . . . . 0.0 108.522 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -31.43 -58.16 0.25 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 127.234 2.214 . . . . 0.0 113.878 -171.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -57.56 -46.15 84.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.707 -0.621 . . . . 0.0 112.12 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -66.08 -43.22 87.97 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.7 mm -54.06 -53.57 27.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 C-N-CA 123.224 0.61 . . . . 0.0 109.796 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -56.34 -52.04 66.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.188 0.595 . . . . 0.0 110.825 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.02 -58.08 8.66 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.64 -54.21 40.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.149 0.98 . . . . 0.0 110.534 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.9 mt -51.08 -50.82 23.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.46 -46.96 85.53 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.482 0.583 . . . . 0.0 111.712 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -57.68 -45.37 85.69 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.855 0.462 . . . . 0.0 110.995 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.24 -34.86 55.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.633 0.254 . . . . 0.0 110.608 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -78.87 76.6 5.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.78 0.832 . . . . 0.0 110.275 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt . . . . . 0 CA--C 1.535 0.386 0 C-N-CA 123.12 0.568 . . . . 0.0 110.313 172.018 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.971 0 CA-C-O 119.633 -0.537 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.8 p -102.69 175.21 5.57 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 170.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.0 mm -116.09 120.43 64.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 172.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.96 158.41 35.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.478 1.111 . . . . 0.0 110.542 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -48.99 -52.97 21.92 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.075 0.55 . . . . 0.0 111.77 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.8 -38.76 92.28 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 119.006 0.821 . . . . 0.0 111.252 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.5 -49.07 79.03 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.926 -0.483 . . . . 0.0 109.781 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.23 -45.73 83.62 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.578 0.751 . . . . 0.0 110.994 175.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.61 -50.37 68.23 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.773 1.229 . . . . 0.0 108.903 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.7 m -58.4 -48.74 79.68 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.068 0.547 . . . . 0.0 110.404 178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.29 -51.37 64.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.727 0.811 . . . . 0.0 110.187 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.1 mmt . . . . . 0 CA--C 1.529 0.152 0 O-C-N 122.288 -0.257 . . . . 0.0 110.68 175.073 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.439 -1.013 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -43.95 -49.24 8.57 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 123.877 0.871 . . . . 0.0 111.669 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -49.62 -49.77 45.61 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.269 0.628 . . . . 0.0 111.827 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -64.63 -42.89 95.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.76 -0.587 . . . . 0.0 109.981 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -59.91 -39.34 85.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.471 0.578 . . . . 0.0 111.557 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -59.47 -53.94 52.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.508 0.723 . . . . 0.0 109.711 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -53.89 -49.08 69.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 83.6 mt -57.57 -43.51 83.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.125 0.97 . . . . 0.0 109.965 177.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -63.25 -44.56 94.83 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.539 -0.725 . . . . 0.0 111.341 177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -56.67 -50.58 71.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.309 0.504 . . . . 0.0 110.145 175.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.12 -52.26 63.83 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 110.372 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.98 -54.13 16.94 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.879 0.872 . . . . 0.0 110.641 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.5 -51.53 66.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.472 0.709 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -52.8 -53.53 47.05 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.89 -38.16 81.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.887 0.475 . . . . 0.0 111.31 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -73.12 62.48 0.65 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.128 0.422 . . . . 0.0 110.268 174.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 p . . . . . 0 N--CA 1.455 -0.212 0 C-N-CA 123.973 0.909 . . . . 0.0 111.139 179.749 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.863 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.3 p -130.45 138.22 50.19 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.723 1.609 . . . . 0.0 107.546 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.0 mt -79.81 110.92 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.104 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -175.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -60.75 147.22 43.16 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.194 -0.316 . . . . 0.0 110.2 173.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.96 -48.07 1.54 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -59.42 -45.21 92.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.958 0.503 . . . . 0.0 111.29 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -62.22 -38.41 89.08 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.002 -0.436 . . . . 0.0 109.852 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.36 -40.09 93.14 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.653 -0.654 . . . . 0.0 110.91 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -58.45 -47.28 84.52 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.321 -0.862 . . . . 0.0 110.738 171.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.1 t -53.99 -49.11 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 118.433 0.561 . . . . 0.0 109.908 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.66 -56.0 18.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.023 0.529 . . . . 0.0 110.82 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 18.0 mtm -53.45 -49.59 67.07 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.042 0.537 . . . . 0.0 111.264 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.97 -48.04 81.15 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.62 95.51 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.84 0.856 . . . . 0.0 111.247 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.16 -30.76 69.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.579 0.752 . . . . 0.0 110.856 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.14 7.53 10.11 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.627 1.108 . . . . 0.0 112.854 171.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -72.14 167.31 20.54 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.29 1.045 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -105.31 87.16 1.91 Allowed Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.865 1.666 . . . . 0.0 108.706 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.87 73.92 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.543 2.162 . . . . 0.0 112.668 -172.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -64.0 115.25 4.73 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.541 0.737 . . . . 0.0 109.253 172.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -41.51 -47.96 3.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.606 1.562 . . . . 0.0 112.333 -174.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.09 -56.12 16.44 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.62 0.768 . . . . 0.0 110.639 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.07 -44.16 85.3 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.555 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 mm -54.41 -53.83 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.54 0.736 . . . . 0.0 110.4 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -54.8 -52.32 63.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.966 0.507 . . . . 0.0 110.414 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -55.24 -59.98 4.03 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 122.907 0.129 . . . . 0.0 110.693 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.3 ttp -53.89 -54.83 33.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.223 0.609 . . . . 0.0 110.568 -176.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.4 mt -55.45 -50.22 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.25 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -57.86 -44.16 86.41 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.359 0.982 . . . . 0.0 111.89 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.97 -47.32 81.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.67 0.214 . . . . 0.0 110.818 177.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 31.9 mm -74.75 -35.28 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 122.136 -0.352 . . . . 0.0 111.625 -177.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -80.03 46.41 0.8 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.308 1.443 . . . . 0.0 111.909 -169.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.449 -0.514 0 O-C-N 121.599 -0.688 . . . . 0.0 110.5 -173.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.002 0 CA-C-O 119.247 -0.752 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p -125.71 122.8 37.35 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.003 0.902 . . . . 0.0 112.022 -173.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.1 mm -75.32 106.45 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.82 158.72 34.95 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.324 0.583 . . . . 0.0 109.846 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -47.74 -40.12 19.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.013 0.925 . . . . 0.0 112.573 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.65 -47.26 79.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.449 1.022 . . . . 0.0 111.727 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.97 -48.12 80.9 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.521 -0.737 . . . . 0.0 110.136 174.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -55.71 -50.68 69.69 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.09 0.471 . . . . 0.0 110.632 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.2 tp -54.18 -49.1 70.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.864 1.665 . . . . 0.0 109.935 175.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.9 m -57.77 -51.31 70.07 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.893 -0.504 . . . . 0.0 110.527 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 59.8 ttp -55.31 -50.07 70.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.941 0.496 . . . . 0.0 109.869 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.292 0 C-N-CA 123.19 0.596 . . . . 0.0 110.32 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -53.96 -42.97 69.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 171.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -56.21 -49.13 74.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.915 0.486 . . . . 0.0 110.605 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -56.01 -48.97 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.704 0.684 . . . . 0.0 111.139 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -55.73 -44.18 77.3 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.287 0.494 . . . . 0.0 111.238 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -57.68 -52.87 63.67 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.777 0.831 . . . . 0.0 109.791 176.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -56.64 -47.06 80.57 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.983 -0.448 . . . . 0.0 111.314 178.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.59 -46.28 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.307 0.643 . . . . 0.0 109.731 176.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -61.84 -46.45 89.4 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.765 -0.584 . . . . 0.0 111.16 178.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -55.57 -51.44 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.865 -0.522 . . . . 0.0 110.32 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.88 67.75 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.978 0.511 . . . . 0.0 110.433 177.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -49.42 -62.58 1.47 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.126 0.571 . . . . 0.0 110.196 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -52.86 -46.2 67.74 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.472 0.709 . . . . 0.0 111.073 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 tt -56.68 -53.2 60.41 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.676 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -62.29 -37.8 86.89 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.267 0.485 . . . . 0.0 110.979 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -70.91 29.27 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.6 2.36 . . . . 0.0 113.307 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.1 p . . . . . 0 CA--C 1.532 0.257 0 C-N-CA 127.168 2.187 . . . . 0.0 112.051 -176.332 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.702 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.0 p -136.45 123.65 21.77 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.418 0.687 . . . . 0.0 109.327 -173.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -72.08 123.9 27.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.83 147.47 41.12 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.41 -49.04 0.7 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.806 1.242 . . . . 0.0 112.8 171.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -54.2 -54.86 34.07 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.059 0.944 . . . . 0.0 110.926 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -57.84 -41.66 82.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.077 0.551 . . . . 0.0 109.84 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 tp -63.78 -46.78 83.67 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.996 -0.44 . . . . 0.0 111.247 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.257 19.9 ptpt -64.2 -36.11 82.99 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.221 -0.924 . . . . 0.0 111.556 177.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.96 -48.42 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.68 0.673 . . . . 0.0 110.105 171.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.2 -54.48 42.86 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.869 0.467 . . . . 0.0 110.493 177.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.8 mtm -53.88 -45.94 71.21 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.953 0.501 . . . . 0.0 111.43 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.24 -49.3 76.48 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.922 -0.486 . . . . 0.0 110.062 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.38 -40.12 77.48 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.784 0.434 . . . . 0.0 111.093 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.98 2.43 5.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.186 0.995 . . . . 0.0 113.027 174.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.59 18.76 65.34 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.185 0.902 . . . . 0.0 113.229 173.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -75.89 167.28 22.16 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.321 1.061 . . . . 0.0 110.092 172.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -109.52 105.85 57.74 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 169.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -56.86 71.67 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 124.887 3.724 . . . . 0.0 115.912 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -68.36 85.34 0.27 Allowed 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 169.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -31.17 -54.39 0.22 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 127.599 2.359 . . . . 0.0 113.629 -173.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -59.73 -48.73 80.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.814 0.446 . . . . 0.0 110.276 -177.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -64.6 -43.34 94.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.323 0.649 . . . . 0.0 109.68 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 mm -54.04 -52.88 32.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 123.182 0.593 . . . . 0.0 109.904 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -57.94 -48.0 81.24 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.215 0.606 . . . . 0.0 110.812 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.31 -54.94 33.49 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 33.8 ttp -56.44 -52.61 64.02 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.352 0.661 . . . . 0.0 110.361 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.5 mt -48.39 -49.57 12.95 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 123.116 0.566 . . . . 0.0 109.646 176.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -59.11 -49.38 78.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.753 -0.165 . . . . 0.0 111.397 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -56.63 -44.31 81.12 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.898 0.317 . . . . 0.0 111.368 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.0 mm -71.52 -34.96 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.692 0.397 . . . . 0.0 110.572 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -79.24 67.95 5.1 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.694 -0.629 . . . . 0.0 110.872 -174.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm . . . . . 0 CA--C 1.538 0.483 0 C-N-CA 125.342 1.457 . . . . 0.0 113.705 176.949 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.015 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.0 p -157.03 161.95 39.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.6 mm -101.21 106.51 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -65.66 154.82 37.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.092 0.557 . . . . 0.0 109.857 169.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -43.73 -52.06 6.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.592 0.757 . . . . 0.0 112.857 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.43 -34.04 77.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.849 0.75 . . . . 0.0 111.297 -177.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -67.95 -42.43 80.96 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.467 -0.77 . . . . 0.0 109.408 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.16 -45.82 90.0 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.058 -0.401 . . . . 0.0 110.446 173.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.13 -47.8 71.49 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.354 1.062 . . . . 0.0 109.025 174.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.1 m -58.2 -49.41 77.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.934 0.494 . . . . 0.0 110.889 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -54.29 -52.71 60.59 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.86 -0.525 . . . . 0.0 110.171 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.258 0 C-N-CA 123.188 0.595 . . . . 0.0 110.044 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 65.8 p . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.853 0.359 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -52.81 -41.86 64.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.913 0.485 . . . . 0.0 109.889 172.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -54.68 -53.59 52.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.147 0.579 . . . . 0.0 110.578 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -56.1 -45.63 79.38 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 122.04 -0.413 . . . . 0.0 110.851 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -55.8 -47.34 77.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.696 0.68 . . . . 0.0 111.112 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -56.19 -51.01 69.59 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.727 0.411 . . . . 0.0 110.277 176.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.7 -51.18 64.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.881 0.31 . . . . 0.0 110.776 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.22 -42.23 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 123.77 0.828 . . . . 0.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -58.98 -51.16 71.25 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.618 0.767 . . . . 0.0 110.167 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.15 -41.15 97.28 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.311 -0.868 . . . . 0.0 111.54 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.6 -51.76 66.06 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.016 -0.428 . . . . 0.0 110.162 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -50.66 -53.77 28.34 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.556 0.742 . . . . 0.0 110.754 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -52.68 -52.92 53.8 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.264 1.026 . . . . 0.0 110.242 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.84 -51.93 65.79 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.284 0.234 . . . . 0.0 110.854 178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -59.78 -39.41 84.8 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.419 -0.175 . . . . 0.0 110.545 -179.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.82 63.83 0.92 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.471 0.709 . . . . 0.0 109.924 172.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 77.5 p . . . . . 0 CA--C 1.536 0.441 0 C-N-CA 123.822 0.849 . . . . 0.0 111.331 171.14 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.084 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -150.06 121.27 7.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.025 1.33 . . . . 0.0 108.45 -169.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.0 mt -81.56 114.66 22.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.16 148.33 50.23 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.906 0.775 . . . . 0.0 110.307 171.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.88 -47.99 1.1 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.053 0.941 . . . . 0.0 113.142 173.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -58.92 -46.52 87.72 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.148 0.579 . . . . 0.0 111.228 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -61.82 -41.18 97.47 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.74 -45.25 93.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.599 0.636 . . . . 0.0 110.492 176.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -54.93 -50.18 69.48 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.702 -0.624 . . . . 0.0 110.233 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.33 -48.19 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.062 0.392 . . . . 0.0 110.542 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.72 -54.83 32.44 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.197 0.599 . . . . 0.0 110.458 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.6 mtm -56.03 -42.43 76.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.831 0.852 . . . . 0.0 110.992 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -60.56 -45.51 93.61 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.834 -0.541 . . . . 0.0 110.621 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.86 -37.99 84.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.533 0.733 . . . . 0.0 111.138 175.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.0 mt -68.22 -0.42 4.67 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.949 0.899 . . . . 0.0 112.121 171.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.5 13.94 66.82 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.786 1.184 . . . . 0.0 112.399 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -79.46 161.96 25.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.291 1.045 . . . . 0.0 109.825 -176.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -105.45 93.82 7.52 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -68.46 83.87 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.133 1.888 . . . . 0.0 112.353 -173.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -60.07 90.2 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.894 1.278 . . . . 0.0 110.041 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -31.37 -59.55 0.24 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 127.353 2.261 . . . . 0.0 114.051 -170.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.4 -47.68 83.1 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.641 0.655 . . . . 0.0 111.795 -176.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -65.8 -41.41 91.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.3 mm -56.69 -50.84 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 122.794 0.438 . . . . 0.0 110.285 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -60.08 -45.34 93.26 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.441 0.564 . . . . 0.0 111.155 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -53.93 -56.62 16.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.24 0.473 . . . . 0.0 110.282 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.9 ttp -54.42 -53.45 53.99 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.978 0.511 . . . . 0.0 110.81 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.5 mt -49.66 -49.54 19.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 123.512 0.725 . . . . 0.0 109.455 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -59.13 -46.22 88.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.342 0.519 . . . . 0.0 111.522 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.12 -42.95 86.9 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.648 0.379 . . . . 0.0 111.448 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.3 mm -74.79 -34.84 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 122.049 -0.407 . . . . 0.0 111.032 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -78.36 80.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.827 0.851 . . . . 0.0 110.63 -173.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 123.556 0.742 . . . . 0.0 110.878 174.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.841 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.3 p -110.49 176.55 5.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.321 0.648 . . . . 0.0 109.543 175.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.1 mm -114.79 114.96 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.986 1.714 . . . . 0.0 106.93 169.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.49 160.08 32.1 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.552 1.141 . . . . 0.0 110.534 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -52.73 -52.07 57.82 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.842 0.457 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.69 -44.72 90.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.322 0.51 . . . . 0.0 110.873 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -56.93 -51.01 70.84 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.82 -48.37 78.14 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.165 0.586 . . . . 0.0 111.287 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -58.83 -45.42 90.04 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 121.804 -0.56 . . . . 0.0 110.0 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.9 m -59.21 -52.24 66.53 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 122.083 -0.385 . . . . 0.0 110.292 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 21.2 ttt -49.21 -55.26 13.07 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.911 0.884 . . . . 0.0 109.982 175.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 44.0 tpp . . . . . 0 N--CA 1.451 -0.387 0 C-N-CA 123.538 0.735 . . . . 0.0 110.211 -178.766 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.452 -0.367 0 CA-C-O 120.974 0.416 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -50.2 -46.91 54.83 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.942 0.497 . . . . 0.0 110.105 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -43.45 -56.29 3.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.165 1.386 . . . . 0.0 111.701 170.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -65.17 -39.75 93.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 121.962 -0.461 . . . . 0.0 110.158 -177.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -60.76 -40.49 92.67 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.647 -0.658 . . . . 0.0 111.088 175.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -57.72 -51.52 69.19 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.787 -0.571 . . . . 0.0 109.838 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.19 -48.11 68.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.064 0.393 . . . . 0.0 111.208 177.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 87.0 mt -57.93 -46.15 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 123.769 0.828 . . . . 0.0 110.042 177.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -60.44 -46.24 90.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.712 0.687 . . . . 0.0 111.014 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -57.69 -52.1 66.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.778 0.431 . . . . 0.0 110.325 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -50.21 69.94 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.746 0.418 . . . . 0.0 110.513 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -51.48 -54.9 22.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.541 0.736 . . . . 0.0 110.722 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -55.22 -49.34 72.22 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.759 0.824 . . . . 0.0 110.562 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 tt -56.06 -52.48 64.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.666 0.212 . . . . 0.0 110.656 178.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -60.13 -42.6 95.16 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.597 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -74.56 64.67 1.21 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.893 0.877 . . . . 0.0 109.735 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 123.628 0.771 . . . . 0.0 111.923 174.675 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.279 0 CA-C-O 119.716 -0.491 . . . . 0.0 114.276 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.8 p -150.09 122.44 8.43 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.03 1.332 . . . . 0.0 109.086 -174.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -80.77 111.08 17.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -63.07 147.62 50.21 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.89 -46.81 1.35 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.507 1.123 . . . . 0.0 113.242 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.4 -48.14 82.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.959 0.504 . . . . 0.0 110.985 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -61.21 -41.52 97.0 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.43 -44.19 95.3 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.939 -0.476 . . . . 0.0 110.299 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -56.42 -49.21 75.2 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.664 -0.648 . . . . 0.0 110.482 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.9 t -54.32 -49.09 66.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.51 -56.46 16.8 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.868 0.467 . . . . 0.0 110.735 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 48.5 mtm -56.05 -44.02 78.44 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.497 0.719 . . . . 0.0 111.487 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -58.11 -51.5 69.45 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.43 78.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.342 0.657 . . . . 0.0 111.474 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -67.55 -10.89 56.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.456 1.103 . . . . 0.0 112.061 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.83 9.41 54.45 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.346 0.974 . . . . 0.0 113.242 172.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -74.15 165.35 25.31 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.7 1.25 . . . . 0.0 109.938 176.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -104.08 92.49 4.59 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.73 77.13 3.09 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 121.786 1.657 . . . . 0.0 112.384 -170.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -60.74 97.42 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.45 1.1 . . . . 0.0 110.124 173.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -31.76 -51.99 0.23 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.691 2.397 . . . . 0.0 113.903 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -58.47 -56.26 24.48 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.089 0.555 . . . . 0.0 111.441 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.71 -42.64 99.75 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.2 mm -58.25 -49.28 82.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 122.976 0.511 . . . . 0.0 110.638 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -57.63 -48.41 79.52 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.393 0.677 . . . . 0.0 109.911 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -53.73 -57.42 10.91 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -54.48 -54.01 46.63 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 110.885 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.5 mt -50.28 -47.26 25.72 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.3 0.64 . . . . 0.0 109.896 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.0 m -62.15 -42.31 99.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.086 0.403 . . . . 0.0 111.604 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.35 -47.11 86.67 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.4 0.546 . . . . 0.0 111.153 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.64 -34.71 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 122.204 -0.31 . . . . 0.0 110.947 -177.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -85.55 92.34 8.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.804 0.841 . . . . 0.0 110.104 -176.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.3 tptt . . . . . 0 CA--C 1.539 0.519 0 C-N-CA 124.686 1.195 . . . . 0.0 112.979 176.371 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.865 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.8 p -140.49 128.68 22.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.529 1.132 . . . . 0.0 109.496 -175.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.4 mm -95.24 108.76 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.67 159.48 34.36 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -51.28 -51.29 55.55 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 121.901 -0.499 . . . . 0.0 111.959 -178.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -53.72 -46.36 70.76 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.933 0.397 . . . . 0.0 111.029 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.48 -47.62 83.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.901 0.48 . . . . 0.0 109.864 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -54.97 -53.2 58.8 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.149 0.58 . . . . 0.0 110.47 176.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -55.18 -47.02 75.79 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.278 0.631 . . . . 0.0 110.001 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.5 m -57.51 -49.73 75.36 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.229 -0.294 . . . . 0.0 110.564 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 53.8 ttp -55.19 -52.75 62.34 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.214 0.606 . . . . 0.0 110.302 178.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 93.6 mmm . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 122.859 0.463 . . . . 0.0 110.134 177.501 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 108.876 -0.786 . . . . 0.0 108.876 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -47.43 -43.99 24.38 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.364 0.665 . . . . 0.0 111.081 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -56.37 -42.94 78.65 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 122.033 -0.417 . . . . 0.0 111.656 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -63.81 -45.36 89.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -55.08 -48.37 73.63 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.093 0.406 . . . . 0.0 110.602 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -55.64 -53.02 61.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.945 0.898 . . . . 0.0 110.139 177.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -53.33 -47.6 69.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 110.945 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.13 -41.86 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.906 -0.496 . . . . 0.0 110.356 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -45.6 92.05 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.562 -0.711 . . . . 0.0 110.172 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -55.87 -52.75 62.98 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.359 -0.838 . . . . 0.0 110.44 176.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.65 -50.47 68.08 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.254 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -50.02 -55.7 13.68 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.322 0.649 . . . . 0.0 110.442 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -54.49 -51.52 64.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 110.629 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.2 -52.09 66.73 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.452 0.168 . . . . 0.0 110.938 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.01 -30.87 71.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.308 -0.245 . . . . 0.0 111.407 -178.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -76.31 47.18 0.45 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.833 1.253 . . . . 0.0 109.586 173.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.395 0 C-N-CA 125.646 1.579 . . . . 0.0 111.626 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.569 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -141.96 135.39 29.32 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.44 0.696 . . . . 0.0 109.877 -172.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 81.2 mt -74.35 112.49 11.47 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.081 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -176.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.26 146.13 48.94 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.566 0.621 . . . . 0.0 109.952 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.17 -47.77 1.19 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.758 0.823 . . . . 0.0 112.803 172.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.61 -45.36 89.36 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 111.376 177.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.1 -38.93 93.13 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.964 -0.46 . . . . 0.0 110.032 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.49 -40.23 92.83 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.725 -0.61 . . . . 0.0 110.502 176.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 tmmm? -57.29 -49.07 77.24 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.481 -0.762 . . . . 0.0 110.562 172.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.1 -50.03 47.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 118.62 0.646 . . . . 0.0 110.385 173.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.31 -55.11 27.34 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.525 0.73 . . . . 0.0 110.602 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 68.7 mtm -56.66 -41.4 77.16 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.337 0.655 . . . . 0.0 111.126 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.94 49.94 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 174.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.25 -40.2 81.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.556 0.742 . . . . 0.0 111.447 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.5 mt -68.16 -3.66 11.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.168 0.987 . . . . 0.0 112.312 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.58 24.25 56.62 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 119.372 0.987 . . . . 0.0 112.317 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.24 172.86 11.05 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -118.22 101.52 51.3 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -55.35 73.34 0.03 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 124.578 3.518 . . . . 0.0 116.704 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -68.99 90.73 0.45 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 169.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -31.61 -49.08 0.16 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.327 2.251 . . . . 0.0 113.197 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.41 -58.66 6.34 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.807 0.843 . . . . 0.0 110.758 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -67.16 -42.86 83.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.786 0.834 . . . . 0.0 109.696 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 12.3 mm -52.2 -56.11 7.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 123.568 0.747 . . . . 0.0 109.652 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.67 -51.36 69.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.342 0.657 . . . . 0.0 110.694 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -53.7 -57.19 11.74 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.806 0.275 . . . . 0.0 110.44 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.93 -53.71 52.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.581 0.752 . . . . 0.0 110.551 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 51.7 mt -50.32 -49.6 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 110.154 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -59.65 -47.28 86.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.031 0.378 . . . . 0.0 111.153 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -57.31 -44.73 84.39 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.6 0.36 . . . . 0.0 111.11 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -71.33 -34.08 52.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 O-C-N 122.196 -0.315 . . . . 0.0 110.885 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -73.63 72.51 1.45 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.028 0.931 . . . . 0.0 110.679 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm . . . . . 0 CA--C 1.534 0.353 0 C-N-CA 123.16 0.584 . . . . 0.0 111.066 173.884 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.86 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -105.43 163.64 12.48 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 117.306 0.553 . . . . 0.0 109.527 169.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.4 mm -120.37 115.31 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.101 1.761 . . . . 0.0 106.709 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -73.51 160.86 31.08 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.315 1.046 . . . . 0.0 110.512 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -49.31 -45.0 44.71 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.328 0.651 . . . . 0.0 111.97 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.5 -46.79 88.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.954 0.797 . . . . 0.0 110.927 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -61.64 -46.8 88.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.92 0.488 . . . . 0.0 109.733 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.06 -48.99 79.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.095 0.558 . . . . 0.0 110.637 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.31 -45.19 76.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.928 0.891 . . . . 0.0 109.918 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.0 m -57.26 -51.67 68.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.873 0.306 . . . . 0.0 110.274 175.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -53.56 -52.13 60.71 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.61 0.364 . . . . 0.0 110.711 177.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.7 mmm . . . . . 0 CA--C 1.534 0.339 0 C-N-CA 123.088 0.555 . . . . 0.0 111.014 -179.22 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.4 p . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -53.44 -34.92 59.7 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.078 0.551 . . . . 0.0 110.971 170.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -64.26 -51.47 63.4 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.226 -0.921 . . . . 0.0 109.857 176.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -55.3 -45.96 76.24 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.278 -0.264 . . . . 0.0 110.416 175.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.42 -39.61 88.04 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.519 -0.738 . . . . 0.0 111.746 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -58.82 -47.76 83.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.16 0.891 . . . . 0.0 111.025 171.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -57.3 -47.3 81.85 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.998 -0.439 . . . . 0.0 110.657 177.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.51 -43.37 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.029 0.931 . . . . 0.0 109.926 178.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -56.8 -51.92 67.06 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.571 0.623 . . . . 0.0 110.323 172.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -53.85 -53.15 56.47 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.649 0.658 . . . . 0.0 110.876 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -50.84 68.68 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.89 0.476 . . . . 0.0 110.654 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -52.64 -53.21 50.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.895 0.878 . . . . 0.0 110.331 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.0 -51.34 68.09 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.443 1.097 . . . . 0.0 110.526 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.38 -51.75 68.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.441 0.162 . . . . 0.0 110.661 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.18 -37.71 81.04 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.823 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -74.59 57.88 0.76 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.663 0.744 . . . . 0.0 109.156 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.41 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -178.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.15 0 N-CA-C 112.073 -0.411 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.3 p -154.46 134.84 13.34 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.808 -1.923 . . . . 0.0 105.808 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -85.99 105.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 169.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.22 149.35 41.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.07 -48.62 1.23 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.867 1.267 . . . . 0.0 112.881 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -57.86 -48.15 80.64 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.844 0.458 . . . . 0.0 111.033 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.77 -39.24 93.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.878 0.471 . . . . 0.0 110.128 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 tp -63.44 -41.91 98.66 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.818 -0.551 . . . . 0.0 109.869 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -59.37 -47.87 83.78 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.749 -0.594 . . . . 0.0 110.452 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.8 t -51.94 -52.02 25.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.489 0.586 . . . . 0.0 110.153 173.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.38 -53.12 55.68 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 123.246 0.619 . . . . 0.0 110.765 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.43 -40.05 85.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.443 0.697 . . . . 0.0 111.54 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.26 -51.65 68.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 172.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.96 -38.11 75.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.848 -0.533 . . . . 0.0 111.841 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -71.58 -1.58 14.03 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.419 1.088 . . . . 0.0 112.183 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 73.12 29.82 64.01 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 119.032 0.833 . . . . 0.0 112.009 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -81.55 169.73 16.73 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 117.586 0.693 . . . . 0.0 109.158 173.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 mp0 -110.54 103.42 54.19 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.808 1.243 . . . . 0.0 107.76 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -57.36 74.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.308 3.338 . . . . 0.0 115.874 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -66.15 85.26 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 169.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -31.45 -55.5 0.26 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.048 2.139 . . . . 0.0 114.031 -172.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.2 -49.1 79.13 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.883 -0.51 . . . . 0.0 111.368 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -62.86 -43.68 98.14 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.306 0.642 . . . . 0.0 109.505 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.2 mm -55.44 -53.47 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.46 0.704 . . . . 0.0 109.863 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.8 -50.93 69.15 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.556 0.342 . . . . 0.0 110.951 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -53.67 -55.5 25.47 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.39 -54.19 43.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.569 0.748 . . . . 0.0 110.732 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.8 mt -51.44 -47.29 35.75 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 -48.1 82.97 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.042 0.383 . . . . 0.0 111.298 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.26 -42.73 77.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.67 0.388 . . . . 0.0 111.178 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.8 mm -76.7 -35.17 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-N 118.068 0.395 . . . . 0.0 111.636 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -85.12 92.78 8.47 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.663 -0.648 . . . . 0.0 111.004 -171.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.897 1.279 . . . . 0.0 113.571 177.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.039 0 CA-C-O 119.4 -0.667 . . . . 0.0 114.45 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.2 p -142.33 136.06 29.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.062 0.931 . . . . 0.0 109.589 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.4 mm -102.16 112.38 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -71.5 158.11 36.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.32 0.648 . . . . 0.0 109.924 170.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.54 -48.65 48.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.559 0.743 . . . . 0.0 112.398 177.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.7 -42.83 89.51 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.25 -0.281 . . . . 0.0 110.266 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -64.82 -46.11 83.36 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.839 0.456 . . . . 0.0 110.118 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.86 -52.71 61.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.921 0.888 . . . . 0.0 110.291 176.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.16 -48.0 79.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.172 0.589 . . . . 0.0 110.028 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.9 m -57.64 -46.54 84.03 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.805 -0.559 . . . . 0.0 110.793 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 55.6 ttp -53.16 -42.98 66.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.672 0.789 . . . . 0.0 110.465 177.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 64.2 mtt . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 177.016 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 38.3 p . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.0 mp0 -55.62 -35.81 66.27 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.012 -0.43 . . . . 0.0 109.961 170.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -68.86 -45.09 71.95 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.537 -0.727 . . . . 0.0 109.969 -179.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.24 -49.74 71.23 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.336 0.516 . . . . 0.0 110.135 171.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -57.79 -47.36 82.78 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.908 -0.495 . . . . 0.0 110.898 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.04 -59.5 4.46 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.278 0.631 . . . . 0.0 110.445 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -48.13 -50.55 28.27 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.924 0.89 . . . . 0.0 111.098 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.86 -45.06 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 122.745 0.418 . . . . 0.0 110.2 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -45.91 90.41 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.779 0.718 . . . . 0.0 110.908 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -49.68 76.77 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.545 -0.722 . . . . 0.0 110.469 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.05 -48.1 73.91 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.989 0.423 . . . . 0.0 110.23 176.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -53.33 -53.33 52.57 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.512 0.725 . . . . 0.0 110.651 176.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -54.54 -50.76 67.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.439 1.096 . . . . 0.0 110.078 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.26 -53.02 62.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -61.15 -37.05 81.49 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.065 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -74.41 60.66 0.87 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.41 0.684 . . . . 0.0 109.925 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 76.4 p . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 124.202 1.001 . . . . 0.0 110.819 173.507 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.006 0 N-CA-C 111.926 -0.469 . . . . 0.0 111.926 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.9 p -158.76 136.63 10.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.032 -1.84 . . . . 0.0 106.032 -169.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 88.4 mt -88.12 114.98 27.58 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 174.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -62.88 146.15 53.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.644 1.111 . . . . 0.0 109.777 173.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.95 -45.48 1.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.04 0.836 . . . . 0.0 113.022 173.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.46 -46.62 88.25 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.821 -0.549 . . . . 0.0 111.165 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.01 -38.59 86.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.934 -0.479 . . . . 0.0 110.13 176.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.14 -43.2 99.35 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.809 -0.557 . . . . 0.0 110.277 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -58.54 -46.22 87.29 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.563 -0.71 . . . . 0.0 110.644 176.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.33 -45.86 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 O-C-N 122.051 -0.406 . . . . 0.0 110.498 173.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.14 -52.55 62.92 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.775 -0.578 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.02 -42.2 89.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.54 0.736 . . . . 0.0 111.347 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -55.31 -49.76 71.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.866 -0.521 . . . . 0.0 110.335 172.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.8 -38.72 86.31 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.142 0.577 . . . . 0.0 111.34 178.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 mt -68.87 -2.47 9.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.292 1.037 . . . . 0.0 112.052 173.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.4 25.49 70.36 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 119.019 0.827 . . . . 0.0 111.978 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.67 165.55 21.9 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -107.11 106.95 59.69 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 169.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -58.87 73.66 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.865 3.044 . . . . 0.0 115.096 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.96 96.3 0.59 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.492 -0.755 . . . . 0.0 109.013 173.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -31.2 -60.31 0.21 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 127.543 2.337 . . . . 0.0 114.081 -172.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -58.02 -54.76 43.25 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.09 -41.76 93.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.695 0.798 . . . . 0.0 110.447 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.8 mm -56.33 -55.61 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.135 0.574 . . . . 0.0 109.938 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -57.7 -46.02 84.91 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 122.379 -0.2 . . . . 0.0 110.84 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -55.19 -57.84 10.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.819 0.448 . . . . 0.0 109.903 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.4 ttp -54.41 -53.6 51.98 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.296 0.638 . . . . 0.0 110.233 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.33 -50.29 28.16 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.59 -44.09 89.72 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.819 0.736 . . . . 0.0 111.913 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -59.52 -39.97 85.62 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.953 -0.467 . . . . 0.0 111.386 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -80.72 -34.56 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 118.136 0.425 . . . . 0.0 111.743 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -85.86 87.61 7.44 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.163 0.985 . . . . 0.0 110.903 -169.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? . . . . . 0 CA--C 1.533 0.304 0 C-N-CA 123.889 0.876 . . . . 0.0 110.586 174.779 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.004 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.6 p -108.03 -179.88 4.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 169.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.7 mm -122.14 119.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -74.96 158.83 32.63 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.087 0.955 . . . . 0.0 110.208 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -50.82 -47.57 60.04 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.614 0.366 . . . . 0.0 111.703 178.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.09 -45.29 87.44 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.128 0.49 . . . . 0.0 110.535 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -62.77 -46.49 87.76 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.976 0.51 . . . . 0.0 110.017 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -58.37 -48.71 79.72 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.94 0.496 . . . . 0.0 110.671 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.61 -49.05 73.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.691 0.796 . . . . 0.0 109.743 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.9 m -55.98 -49.74 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 117.957 0.344 . . . . 0.0 110.499 178.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.4 ttp -54.32 -53.86 48.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.01 0.524 . . . . 0.0 110.498 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.1 mmt . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 110.523 -0.177 . . . . 0.0 110.523 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.1 p . . . . . 0 CA--C 1.531 0.229 0 CA-C-O 121.03 0.443 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -54.44 -42.12 70.22 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 172.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -52.67 -55.3 23.54 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.797 0.839 . . . . 0.0 109.858 175.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -53.86 -50.49 66.15 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 119.117 -0.468 . . . . 0.0 110.843 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.86 -47.61 73.98 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.738 0.699 . . . . 0.0 111.268 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -57.95 -50.32 73.76 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.008 0.523 . . . . 0.0 110.855 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -58.5 -47.28 84.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.111 0.414 . . . . 0.0 111.118 178.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.77 -41.59 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -62.41 -47.48 83.92 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.64 -0.663 . . . . 0.0 110.948 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -53.97 -53.47 52.35 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.91 -49.25 69.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.99 0.516 . . . . 0.0 110.466 177.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -52.49 -57.64 9.27 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.354 0.662 . . . . 0.0 110.994 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -56.86 -47.53 80.2 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.943 0.497 . . . . 0.0 110.402 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.8 tt -54.92 -53.74 51.61 Favored 'General case' 0 C--N 1.338 0.074 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -60.01 -37.78 80.75 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.172 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -73.75 61.88 0.78 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.703 0.683 . . . . 0.0 109.601 169.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 57.0 p . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.664 1.186 . . . . 0.0 111.158 -179.794 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.027 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -130.76 147.04 52.37 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.914 2.086 . . . . 0.0 108.26 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.92 119.95 27.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.46 144.6 57.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.581 1.082 . . . . 0.0 110.1 173.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.03 -48.79 1.23 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -62.5 -43.51 98.65 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.722 -0.611 . . . . 0.0 110.945 179.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -60.17 -40.32 89.5 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.944 -0.473 . . . . 0.0 109.979 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -63.06 -43.91 97.29 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.786 -0.571 . . . . 0.0 110.223 175.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -57.48 -48.51 79.02 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.479 -0.763 . . . . 0.0 110.744 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.6 t -53.68 -50.58 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.781 0.433 . . . . 0.0 110.327 172.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.58 -53.19 49.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.117 0.567 . . . . 0.0 110.543 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 69.7 mtm -60.18 -42.71 95.58 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.356 0.662 . . . . 0.0 111.188 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -58.38 6.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.14 82.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.908 0.883 . . . . 0.0 112.19 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.94 -16.5 59.47 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.723 1.209 . . . . 0.0 111.76 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.32 24.47 12.49 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 118.637 0.653 . . . . 0.0 112.334 175.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -80.57 176.79 9.48 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -115.39 97.81 49.25 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -60.98 66.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.249 3.299 . . . . 0.0 116.684 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.64 104.99 1.13 Allowed 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.35 -0.844 . . . . 0.0 109.071 171.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -42.49 -46.83 4.94 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.525 1.53 . . . . 0.0 114.139 -170.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -59.72 -57.56 12.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.29 0.496 . . . . 0.0 110.37 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -58.32 -44.97 88.89 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.712 0.805 . . . . 0.0 109.929 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -53.43 -57.83 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.569 0.747 . . . . 0.0 110.18 175.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -57.72 -47.3 82.79 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.067 0.394 . . . . 0.0 111.097 -178.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -55.12 -58.2 8.65 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 52.7 ttp -56.1 -52.24 65.03 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.842 0.457 . . . . 0.0 110.567 -178.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 39.3 mt -49.79 -51.18 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.1 m -57.53 -49.72 75.42 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.173 0.442 . . . . 0.0 111.477 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -56.88 -43.53 81.37 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 117.838 0.29 . . . . 0.0 111.467 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 mm -71.59 -34.78 53.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 122.01 -0.431 . . . . 0.0 110.673 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -78.9 71.4 5.36 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.481 0.713 . . . . 0.0 111.682 -169.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm . . . . . 0 CA--C 1.536 0.413 0 C-N-CA 123.303 0.641 . . . . 0.0 111.845 176.021 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.887 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -102.78 175.94 5.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.9 mm -128.33 118.44 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 175.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -77.36 170.01 17.3 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.5 0.667 . . . . 0.0 111.221 177.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.44 -36.25 73.37 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.624 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -69.43 -50.17 48.25 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.439 0.563 . . . . 0.0 109.706 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -54.11 -50.2 67.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.914 0.886 . . . . 0.0 109.92 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -56.53 -54.85 41.09 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.958 0.503 . . . . 0.0 110.747 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.08 -47.24 68.69 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.601 0.76 . . . . 0.0 110.128 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 m -56.23 -52.05 65.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.619 0.368 . . . . 0.0 110.343 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 47.5 ttp -55.2 -56.82 15.64 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.0 mmm . . . . . 0 N--CA 1.455 -0.2 0 C-N-CA 122.869 0.468 . . . . 0.0 110.28 -177.576 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 p . . . . . 0 C--O 1.235 0.301 0 CA-C-O 120.902 0.382 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -57.55 -41.49 81.07 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 121.688 -0.632 . . . . 0.0 109.666 169.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.6 mp0 -55.18 -52.87 61.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.518 0.727 . . . . 0.0 109.973 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -55.41 -51.1 67.98 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.921 -0.487 . . . . 0.0 111.141 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.33 -41.93 90.25 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.711 0.687 . . . . 0.0 111.646 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -57.89 -53.63 56.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.114 1.366 . . . . 0.0 110.072 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -53.75 -48.7 69.44 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.234 0.614 . . . . 0.0 110.59 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.4 mt -60.35 -42.07 89.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 122.828 0.451 . . . . 0.0 110.276 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -61.35 -45.63 93.58 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.593 0.633 . . . . 0.0 110.851 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -58.04 -50.72 72.45 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.47 0.577 . . . . 0.0 110.672 177.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.55 -52.54 61.75 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -48.08 -60.15 2.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.532 0.733 . . . . 0.0 109.877 175.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -51.31 -49.18 61.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.321 1.048 . . . . 0.0 110.825 -177.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.86 -52.64 64.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.703 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -61.51 -36.37 80.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.172 0.442 . . . . 0.0 111.506 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -72.74 31.68 0.06 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.313 2.245 . . . . 0.0 113.071 -173.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.2 p . . . . . 0 CA--C 1.528 0.127 0 C-N-CA 127.512 2.325 . . . . 0.0 111.796 -173.39 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.707 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 p -135.69 120.96 19.04 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 117.788 0.794 . . . . 0.0 110.239 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.7 mt -72.89 114.12 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.18 147.38 51.07 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.203 0.456 . . . . 0.0 110.216 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.47 -47.85 0.92 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.053 0.941 . . . . 0.0 113.178 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -58.36 -49.26 77.84 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.927 0.491 . . . . 0.0 111.168 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -59.08 -42.75 91.18 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.29 -42.34 99.27 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.966 -0.458 . . . . 0.0 110.902 177.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.02 -47.91 83.9 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.335 -0.853 . . . . 0.0 110.445 176.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.4 t -54.62 -48.62 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 173.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -53.27 55.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.862 0.465 . . . . 0.0 110.584 177.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mtm -57.95 -42.65 85.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.271 0.628 . . . . 0.0 111.599 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -56.57 -52.07 66.2 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.512 0.596 . . . . 0.0 110.116 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.49 75.57 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 122.093 -0.38 . . . . 0.0 111.64 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -72.28 -2.49 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.863 1.265 . . . . 0.0 112.355 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.49 20.94 61.07 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 119.235 0.925 . . . . 0.0 113.362 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -83.36 159.68 21.8 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.259 1.029 . . . . 0.0 109.763 171.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -104.43 98.75 15.2 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 169.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.36 80.47 1.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.357 2.038 . . . . 0.0 112.15 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -59.79 90.54 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.213 1.405 . . . . 0.0 109.518 170.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -32.39 -51.7 0.27 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.058 2.143 . . . . 0.0 115.207 -171.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -60.15 -51.31 70.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.822 0.737 . . . . 0.0 110.535 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -62.79 -41.11 99.13 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.0 mm -59.16 -47.86 88.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.936 0.494 . . . . 0.0 110.562 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.67 -48.17 81.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.852 0.751 . . . . 0.0 110.453 177.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -54.7 -58.06 9.01 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -48.35 -59.61 3.32 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.421 1.488 . . . . 0.0 110.713 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.7 mt -51.38 -49.27 32.2 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 C-N-CA 123.472 0.709 . . . . 0.0 109.907 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.2 m -60.06 -47.1 87.28 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.582 0.628 . . . . 0.0 111.592 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.8 -45.49 85.99 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.483 0.313 . . . . 0.0 110.885 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.0 mm -71.65 -35.6 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 111.168 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -82.2 75.25 9.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.54 -0.725 . . . . 0.0 110.507 -170.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp . . . . . 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 0.0 113.11 172.857 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.133 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p -136.1 150.01 48.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.93 0.892 . . . . 0.0 108.931 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.3 mm -109.11 110.24 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 125.006 1.322 . . . . 0.0 108.102 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.21 152.09 45.58 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 171.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.7 -44.77 13.81 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -59.5 -46.8 87.8 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.489 0.586 . . . . 0.0 110.921 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -62.84 -45.95 90.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.019 0.528 . . . . 0.0 109.731 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -56.48 -50.81 70.65 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 123.7 0.8 . . . . 0.0 110.628 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.98 -46.91 84.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.723 0.809 . . . . 0.0 109.709 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.1 m -56.54 -53.7 54.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 117.832 0.287 . . . . 0.0 110.346 177.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -51.33 -53.96 31.0 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.095 0.958 . . . . 0.0 110.053 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 N--CA 1.449 -0.523 0 C-N-CA 123.024 0.53 . . . . 0.0 110.411 -176.421 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.449 -0.475 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -56.06 -37.82 69.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.418 -0.801 . . . . 0.0 110.654 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -56.41 -53.66 54.82 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.169 0.588 . . . . 0.0 110.415 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -55.65 -44.87 77.59 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 175.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -53.59 -43.72 68.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.875 0.47 . . . . 0.0 111.243 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -58.26 -53.23 60.61 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -55.26 -44.35 75.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.543 0.211 . . . . 0.0 111.22 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.47 -45.31 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.016 0.926 . . . . 0.0 109.8 178.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -57.45 -52.47 65.24 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.283 0.492 . . . . 0.0 110.604 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -54.45 -50.84 66.75 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.483 -0.761 . . . . 0.0 111.221 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.8 72.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.195 0.598 . . . . 0.0 110.559 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -52.41 -53.68 41.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.704 0.801 . . . . 0.0 110.311 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -56.49 -50.65 71.16 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.254 0.621 . . . . 0.0 110.211 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.1 tt -57.18 -52.23 66.16 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -60.45 -39.07 86.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.113 0.165 . . . . 0.0 110.595 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -74.25 58.14 0.7 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 C-N-CA 124.343 1.057 . . . . 0.0 110.684 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.125 0 N-CA-C 112.427 -0.269 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.1 p -158.18 143.65 16.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 -169.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.7 mt -87.89 110.81 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.07 147.28 44.33 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.459 1.027 . . . . 0.0 110.324 175.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.43 -48.54 1.96 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.907 0.776 . . . . 0.0 113.037 173.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -59.3 -45.93 89.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.836 0.454 . . . . 0.0 110.996 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.22 -36.59 82.44 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.992 -0.442 . . . . 0.0 110.517 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.89 -41.89 90.97 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.651 -0.655 . . . . 0.0 110.069 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -57.89 -49.45 76.67 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.738 -0.601 . . . . 0.0 110.294 173.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 38.5 t -51.98 -51.37 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.066 0.394 . . . . 0.0 110.16 173.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -55.9 21.97 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.721 0.808 . . . . 0.0 110.743 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.6 mtm -54.84 -45.72 74.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.36 0.664 . . . . 0.0 110.99 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -58.22 -48.01 81.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.756 -0.59 . . . . 0.0 110.444 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.16 79.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.978 0.511 . . . . 0.0 111.35 176.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -70.1 -0.47 7.77 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.532 1.133 . . . . 0.0 112.222 174.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.81 16.76 62.87 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-N 119.117 0.872 . . . . 0.0 112.771 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -75.93 162.05 28.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.267 1.033 . . . . 0.0 109.436 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -108.19 105.77 57.21 Favored Pre-proline 0 N--CA 1.449 -0.506 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -56.13 78.5 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.312 3.341 . . . . 0.0 115.253 -178.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.35 81.37 0.09 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.161 0.984 . . . . 0.0 108.933 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -31.72 -56.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 127.329 2.252 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.98 -50.89 67.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.971 0.415 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.65 -40.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.07 0.548 . . . . 0.0 109.692 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.1 mm -53.64 -54.78 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -56.09 -52.67 63.46 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.673 0.789 . . . . 0.0 109.775 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -52.44 -57.86 8.54 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.897 0.479 . . . . 0.0 110.308 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -51.76 -54.46 28.34 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.8 0.84 . . . . 0.0 110.582 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.4 mt -51.61 -49.67 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -57.06 -48.1 79.37 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.056 0.389 . . . . 0.0 111.419 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -58.96 -42.35 89.68 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.94 0.337 . . . . 0.0 111.094 178.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.06 -31.32 44.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 O-C-N 122.156 -0.34 . . . . 0.0 111.231 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.37 75.74 0.54 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.855 0.862 . . . . 0.0 111.635 -173.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? . . . . . 0 N--CA 1.447 -0.58 0 C-N-CA 125.907 1.683 . . . . 0.0 109.848 171.152 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.194 0 CA-C-O 119.462 -0.632 . . . . 0.0 113.252 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 p -113.99 171.8 7.38 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.138 0.969 . . . . 0.0 108.815 169.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.6 mm -112.05 116.22 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 169.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.96 156.54 39.49 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.429 0.692 . . . . 0.0 109.783 174.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -51.99 -43.45 63.62 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.904 -0.497 . . . . 0.0 111.728 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -57.45 -46.38 83.68 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.354 0.524 . . . . 0.0 110.66 178.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.15 -47.42 82.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.753 0.421 . . . . 0.0 110.113 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -57.02 -51.71 68.16 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.691 0.758 . . . . 0.0 110.304 178.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.2 tp -52.87 -46.27 67.8 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.957 0.903 . . . . 0.0 110.044 174.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 59.2 m -58.3 -47.85 82.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.319 0.509 . . . . 0.0 111.192 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 77.5 mtp -53.26 -51.29 62.71 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.695 0.679 . . . . 0.0 109.827 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.862 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 29.3 m -75.8 129.41 37.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 176.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 159.81 154.63 7.37 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.8 mt -121.8 94.37 4.29 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 125.475 1.51 . . . . 0.0 109.895 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 158.4 26.43 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 171.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -45.37 -45.51 12.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.907 0.883 . . . . 0.0 111.863 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.0 mp0 -55.95 -47.44 77.57 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 122.908 0.483 . . . . 0.0 110.834 177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -61.99 -43.97 97.71 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -59.24 -44.11 92.35 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.233 -0.292 . . . . 0.0 110.849 178.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -57.86 -51.78 68.17 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.209 0.604 . . . . 0.0 110.006 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -52.96 -50.23 64.51 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.128 0.422 . . . . 0.0 111.058 177.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.76 -46.09 79.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 124.023 0.929 . . . . 0.0 110.377 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -61.17 -49.18 78.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.796 -0.565 . . . . 0.0 111.067 177.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -55.83 -52.27 64.58 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.568 -0.708 . . . . 0.0 110.569 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -47.82 75.25 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.389 0.676 . . . . 0.0 110.554 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.8 -55.52 22.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.553 0.741 . . . . 0.0 110.225 177.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.64 -50.24 70.73 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.856 0.463 . . . . 0.0 110.24 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 tt -55.8 -53.5 55.89 Favored 'General case' 0 N--CA 1.457 -0.099 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 178.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -59.91 -36.86 77.88 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 119.49 -0.29 . . . . 0.0 110.941 -178.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -73.83 60.85 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.458 0.572 . . . . 0.0 109.992 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.7 p -53.79 -37.17 63.21 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.481 1.113 . . . . 0.0 111.175 178.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.45 -22.98 66.82 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.007 0.523 . . . . 0.0 112.076 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.48 31.48 80.37 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 111.511 -0.635 . . . . 0.0 111.511 -173.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -24.16 65.55 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.73 0.765 . . . . 0.0 111.909 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.4 61.36 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.824 1.202 . . . . 0.0 110.332 -169.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.6 p -138.27 144.99 40.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.952 1.701 . . . . 0.0 107.09 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.5 mt -80.82 116.81 25.73 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.062 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 177.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -65.98 147.44 53.35 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.11 0.868 . . . . 0.0 110.3 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.76 -46.76 1.3 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.782 0.833 . . . . 0.0 113.213 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.02 -46.41 89.58 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.806 -0.559 . . . . 0.0 111.233 177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.51 -38.81 88.72 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 122.014 -0.429 . . . . 0.0 109.904 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.8 -43.49 98.66 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.843 -0.536 . . . . 0.0 110.389 175.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 tmmm? -57.02 -48.75 77.75 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.474 -0.766 . . . . 0.0 110.096 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -55.05 -48.03 76.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.731 -0.605 . . . . 0.0 110.551 174.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.18 -48.85 70.48 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 122.873 0.469 . . . . 0.0 110.633 177.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.3 mtm -61.6 -38.03 86.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.737 -0.602 . . . . 0.0 111.583 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 18.8 mmt180 -60.94 -43.41 98.71 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.464 -0.773 . . . . 0.0 111.355 169.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.45 77.09 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.023 0.829 . . . . 0.0 111.331 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.47 -0.62 13.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.088 0.955 . . . . 0.0 112.501 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.66 24.05 68.46 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.406 1.003 . . . . 0.0 112.709 175.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -80.03 165.95 22.03 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.084 0.942 . . . . 0.0 110.525 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -116.19 92.85 37.24 Favored Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 125.737 1.615 . . . . 0.0 107.835 170.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -53.17 140.08 61.63 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.952 3.101 . . . . 0.0 112.98 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -135.95 119.17 16.63 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -40.31 -58.52 1.5 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.289 1.436 . . . . 0.0 114.633 -169.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -51.41 69.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.774 0.43 . . . . 0.0 111.674 -177.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -57.45 -50.69 72.19 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.921 0.488 . . . . 0.0 110.038 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.76 -54.22 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 C-N-CA 123.998 0.919 . . . . 0.0 109.786 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -55.44 -50.95 68.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.444 0.697 . . . . 0.0 110.593 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -62.7 -51.45 67.15 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -177.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.77 -53.29 56.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.222 0.609 . . . . 0.0 110.071 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.3 mt -50.67 -49.37 25.7 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.783 174.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -58.64 -44.73 90.16 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.566 1.075 . . . . 0.0 111.471 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -58.67 -47.78 83.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.432 0.293 . . . . 0.0 110.744 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 34.6 mm -71.6 -34.66 53.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 120.716 0.293 . . . . 0.0 110.772 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -81.08 70.45 7.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.714 1.205 . . . . 0.0 109.442 -174.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -62.55 -40.97 98.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.244 173.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -138.72 -28.92 0.8 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.351 1.061 . . . . 0.0 113.438 -172.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.18 -12.07 22.2 Favored Glycine 0 CA--C 1.539 1.559 0 N-CA-C 115.632 1.013 . . . . 0.0 115.632 -169.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.1 m 48.13 67.23 0.87 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.747 1.619 . . . . 0.0 113.265 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 93.43 -19.71 50.94 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -113.54 166.46 11.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 169.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 37.6 mm -118.54 116.88 52.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 125.622 1.569 . . . . 0.0 107.142 176.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -72.16 160.6 32.17 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.561 1.144 . . . . 0.0 110.651 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -48.68 -48.72 39.83 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.368 0.667 . . . . 0.0 111.781 176.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 70.4 mm-40 -63.93 -40.65 96.94 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.787 0.721 . . . . 0.0 111.356 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -62.77 -47.46 83.39 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.68 -0.638 . . . . 0.0 109.654 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -59.31 -46.63 88.06 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.415 0.686 . . . . 0.0 110.715 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.2 tp -55.16 -48.17 74.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.693 1.197 . . . . 0.0 109.509 175.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.3 m -56.75 -51.09 70.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.288 0.494 . . . . 0.0 110.432 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.7 ttp -51.8 -52.08 51.69 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 176.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -39.93 92.67 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.092 0.557 . . . . 0.0 111.077 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.8 m -58.46 -46.08 87.3 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.394 0.543 . . . . 0.0 109.849 175.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.86 -52.6 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.239 0.216 . . . . 0.0 111.433 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -81.12 -38.26 27.51 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.234 0.614 . . . . 0.0 112.605 -169.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 78.7 mtp . . . . . 0 C--O 1.252 1.208 0 CA-C-O 116.388 -1.768 . . . . 0.0 111.1 -169.883 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.5 t -74.93 74.85 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -176.02 -168.24 35.99 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 mt -69.46 107.49 3.37 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 117.25 0.525 . . . . 0.0 110.233 177.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.7 p -64.73 164.96 11.17 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.984 0.421 . . . . 0.0 109.883 171.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -50.81 -47.14 60.06 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -51.43 -52.38 46.67 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.352 0.661 . . . . 0.0 110.677 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -57.45 -48.52 78.96 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 122.147 -0.346 . . . . 0.0 110.62 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -58.52 -40.49 83.07 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.602 0.637 . . . . 0.0 111.707 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -58.33 -52.66 64.68 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.51 0.724 . . . . 0.0 109.838 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.43 -45.97 87.43 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.202 -0.311 . . . . 0.0 111.352 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.47 -46.45 82.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 123.729 0.812 . . . . 0.0 109.597 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -61.64 -44.95 96.01 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.383 0.538 . . . . 0.0 111.013 177.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -55.88 -55.25 34.86 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.456 0.571 . . . . 0.0 110.114 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.77 -49.46 70.83 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.871 0.468 . . . . 0.0 110.03 178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -51.82 -52.68 47.46 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 122.887 0.475 . . . . 0.0 110.733 177.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -56.53 -49.17 75.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.755 0.822 . . . . 0.0 110.606 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 tp -53.37 -54.77 31.83 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -61.58 -43.05 99.58 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.456 -0.152 . . . . 0.0 110.909 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -74.99 62.69 1.15 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.696 1.198 . . . . 0.0 109.547 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 75.0 p -54.24 -33.06 57.56 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.131 0.972 . . . . 0.0 111.169 173.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -63.87 -22.26 66.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.155 0.582 . . . . 0.0 112.249 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.68 28.73 72.03 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.958 0.789 . . . . 0.0 112.132 -177.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.0 p -92.32 9.08 35.51 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.072 0.949 . . . . 0.0 112.64 -173.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.16 16.66 62.6 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.128 0.87 . . . . 0.0 111.545 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.3 p -148.33 121.71 9.05 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.109 1.764 . . . . 0.0 107.536 -169.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.0 mt -80.37 110.38 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 169.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.73 148.68 45.97 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.24 -46.24 1.49 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.551 1.14 . . . . 0.0 113.062 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -59.18 -48.03 83.12 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.061 0.457 . . . . 0.0 110.926 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -61.51 -39.69 91.9 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 122.017 -0.427 . . . . 0.0 109.942 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.2 tp -63.56 -42.56 98.34 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.611 -0.681 . . . . 0.0 110.383 176.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -57.74 -48.04 80.75 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.687 -0.633 . . . . 0.0 110.168 175.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.3 t -54.23 -49.46 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 122.014 -0.429 . . . . 0.0 110.554 173.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.79 -49.08 69.1 Favored 'General case' 0 C--O 1.225 -0.204 0 O-C-N 121.993 -0.442 . . . . 0.0 110.675 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -61.13 -39.88 91.7 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.084 0.554 . . . . 0.0 111.382 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -60.13 -43.35 95.73 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.245 -0.91 . . . . 0.0 111.437 170.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.85 -37.77 77.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.951 0.796 . . . . 0.0 111.346 173.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -72.82 -0.84 14.52 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 124.042 0.937 . . . . 0.0 112.647 173.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.43 25.67 69.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.318 0.961 . . . . 0.0 112.616 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -82.55 167.06 18.72 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 117.791 0.796 . . . . 0.0 111.035 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -109.35 107.23 59.5 Favored Pre-proline 0 CA--C 1.536 0.418 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 169.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_exo -56.87 77.19 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 124.638 3.559 . . . . 0.0 114.459 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -65.84 82.5 0.07 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.364 1.066 . . . . 0.0 109.044 170.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -31.29 -55.4 0.24 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 127.817 2.447 . . . . 0.0 114.288 -169.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 mp0 -59.33 -53.27 60.15 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.33 0.586 . . . . 0.0 110.134 -176.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.0 mp0 -62.68 -41.66 99.22 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.764 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.99 -52.83 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.095 0.558 . . . . 0.0 109.89 174.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -51.3 70.15 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -53.34 -56.12 19.31 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.483 0.313 . . . . 0.0 110.577 178.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 39.0 ttp -50.89 -57.92 7.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.303 0.641 . . . . 0.0 110.103 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.3 mt -51.47 -44.22 32.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.194 0 C-N-CA 122.724 0.41 . . . . 0.0 110.022 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.2 m -61.75 -49.44 76.41 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.185 0.448 . . . . 0.0 111.558 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -58.09 -45.22 87.53 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.055 0.389 . . . . 0.0 110.848 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.02 -34.21 49.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.241 -0.287 . . . . 0.0 111.101 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -89.46 88.45 7.46 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.65 0.659 . . . . 0.0 110.35 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.06 -19.43 65.99 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.72 0.808 . . . . 0.0 112.246 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -81.8 -44.88 16.36 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 108.91 -15.75 33.72 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.285 1.422 . . . . 0.0 113.334 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.7 m -78.48 38.82 0.32 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.328 1.564 . . . . 0.0 114.048 -169.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 53.74 39.21 60.91 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 124.583 1.087 . . . . 0.0 113.059 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.0 p -137.62 124.62 21.43 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 124.746 1.219 . . . . 0.0 109.602 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.5 mm -91.59 104.34 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 173.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.83 151.3 39.37 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -45.41 -47.98 13.64 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.39 -42.35 86.91 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.499 0.591 . . . . 0.0 111.202 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -66.1 -45.38 81.39 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.6 t80 -55.9 -49.94 72.04 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.697 0.399 . . . . 0.0 110.439 174.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 tt -54.28 -49.75 68.89 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 108.902 177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.6 m -55.85 -49.68 72.67 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.932 -0.48 . . . . 0.0 111.087 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.7 ttp -54.0 -51.54 63.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.827 -0.545 . . . . 0.0 110.156 177.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 91.4 mmm -62.93 -33.49 75.47 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 122.026 -0.422 . . . . 0.0 111.559 178.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 31.5 m -63.02 -41.7 99.61 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.669 0.668 . . . . 0.0 110.001 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.43 -49.27 69.81 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.123 -0.361 . . . . 0.0 110.676 176.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.22 -49.58 59.76 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 37.9 mtm . . . . . 0 C--O 1.251 1.153 0 C-N-CA 125.053 1.341 . . . . 0.0 110.837 -169.313 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.1 m -52.87 121.65 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 128.72 -38.59 2.02 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -169.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.3 mt -57.82 130.93 48.7 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 169.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -65.3 155.08 36.38 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -178.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -53.32 -36.07 60.85 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.166 -0.334 . . . . 0.0 110.112 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.92 -58.12 9.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.948 0.499 . . . . 0.0 110.307 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -52.67 -47.61 67.05 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.86 -0.525 . . . . 0.0 110.685 176.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -57.61 -44.57 85.56 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 122.228 -0.295 . . . . 0.0 110.802 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -47.07 88.11 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.902 -0.499 . . . . 0.0 110.25 177.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -58.13 -48.89 78.83 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.908 0.385 . . . . 0.0 110.225 178.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -58.58 -41.27 81.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -61.84 -47.7 83.91 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.728 -0.607 . . . . 0.0 111.237 175.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -56.8 -49.31 75.74 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.73 0.695 . . . . 0.0 110.38 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.05 -50.01 67.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.559 0.344 . . . . 0.0 110.736 176.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -51.77 -57.5 9.11 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.343 0.657 . . . . 0.0 110.725 177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -57.54 -45.71 84.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 110.69 -177.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 tt -56.24 -53.16 60.51 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.0 -37.34 79.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 119.746 -0.168 . . . . 0.0 110.907 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -73.66 59.82 0.66 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.174 0.443 . . . . 0.0 110.283 170.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 68.2 p -53.23 -36.42 61.02 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.37 1.068 . . . . 0.0 111.158 176.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.76 -23.24 67.18 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.382 0.673 . . . . 0.0 112.185 178.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.56 30.33 77.21 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 111.733 -0.547 . . . . 0.0 111.733 -174.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.04 -24.39 65.99 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.839 0.82 . . . . 0.0 111.94 178.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.15 -10.28 65.56 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 124.684 1.135 . . . . 0.0 110.507 -169.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p -141.0 145.5 36.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.313 1.845 . . . . 0.0 106.653 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 95.1 mt -82.87 120.08 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 107.354 -1.351 . . . . 0.0 107.354 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -68.15 146.26 53.59 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 119.422 1.01 . . . . 0.0 110.426 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.49 -48.33 0.97 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.895 0.878 . . . . 0.0 113.192 173.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.28 -48.27 81.01 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.939 0.496 . . . . 0.0 111.217 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -60.72 -39.51 88.89 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.766 0.426 . . . . 0.0 110.118 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.02 -40.86 99.03 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.869 -0.52 . . . . 0.0 110.549 176.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -61.07 -47.28 87.09 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.626 -0.671 . . . . 0.0 110.67 174.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -52.86 -50.47 43.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.446 0.566 . . . . 0.0 110.145 173.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.53 -53.65 48.58 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 123.16 0.584 . . . . 0.0 110.408 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.8 mtm -56.35 -46.1 80.15 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.387 0.675 . . . . 0.0 111.874 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -54.46 -51.02 66.32 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.437 0.562 . . . . 0.0 110.726 172.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.77 73.8 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.966 -0.459 . . . . 0.0 111.763 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.5 mt -74.99 -0.58 19.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.764 1.226 . . . . 0.0 112.258 176.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 77.75 25.05 63.41 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 119.189 0.904 . . . . 0.0 112.878 176.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -76.8 166.19 23.68 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 117.953 0.876 . . . . 0.0 109.259 170.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -108.77 109.93 61.19 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -58.48 66.02 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 124.764 3.643 . . . . 0.0 115.94 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.94 90.16 0.43 Allowed 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 171.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -31.42 -52.28 0.21 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.97 2.108 . . . . 0.0 113.966 -172.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -62.12 -49.11 77.18 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.341 0.656 . . . . 0.0 110.639 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.68 -47.45 86.2 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.984 0.913 . . . . 0.0 109.307 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.7 mm -54.7 -53.64 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -57.58 -49.39 76.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 123.615 0.766 . . . . 0.0 110.387 -179.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -54.81 -56.91 14.29 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.453 0.301 . . . . 0.0 110.257 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.3 ttp -51.74 -56.97 10.66 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.793 0.437 . . . . 0.0 110.355 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.51 -50.6 21.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 C-N-CA 123.047 0.539 . . . . 0.0 109.631 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.6 m -58.5 -49.07 78.69 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 118.312 0.505 . . . . 0.0 111.447 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -56.78 -44.76 82.17 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 117.85 0.296 . . . . 0.0 111.079 178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.3 mm -71.51 -35.09 55.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 O-C-N 121.997 -0.44 . . . . 0.0 111.118 -179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -80.12 73.92 6.93 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.563 0.745 . . . . 0.0 110.744 -170.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -66.71 -39.69 88.14 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.232 0.613 . . . . 0.0 111.727 173.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -130.53 -44.02 1.12 Allowed 'General case' 0 C--N 1.34 0.167 0 C-N-CA 124.781 1.232 . . . . 0.0 112.494 -169.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -53.97 -15.62 5.21 Favored Glycine 0 CA--C 1.54 1.643 0 N-CA-C 117.086 1.594 . . . . 0.0 117.086 -169.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 m 47.43 65.3 1.3 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.474 1.51 . . . . 0.0 112.938 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.72 -27.19 20.02 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -177.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 26.6 p -105.95 170.24 8.02 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -121.46 119.21 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.671 1.588 . . . . 0.0 107.153 177.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.2 157.51 37.6 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.751 0.82 . . . . 0.0 110.479 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -47.14 -50.15 20.91 Favored 'General case' 0 C--O 1.227 -0.119 0 C-N-CA 123.515 0.726 . . . . 0.0 112.081 177.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -61.11 -39.81 91.37 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.41 0.55 . . . . 0.0 111.203 -178.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 -66.38 -46.64 75.99 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.671 0.789 . . . . 0.0 109.75 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -56.4 -46.97 79.91 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.17 0.588 . . . . 0.0 110.331 174.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.68 -45.73 81.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.643 0.777 . . . . 0.0 109.213 176.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.9 m -53.43 -54.24 39.74 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.797 -0.564 . . . . 0.0 110.879 173.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -53.62 -51.85 61.73 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.081 0.552 . . . . 0.0 110.15 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.3 tpt -56.87 -48.68 77.56 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.279 0.632 . . . . 0.0 110.06 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.1 m -55.2 -48.37 73.93 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.224 0.61 . . . . 0.0 110.358 177.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.41 97.72 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.556 0.342 . . . . 0.0 111.427 178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -65.28 -46.19 81.44 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.338 0.655 . . . . 0.0 110.961 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 67.5 mtm . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.783 -1.58 . . . . 0.0 111.023 179.136 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.3 m -76.35 63.37 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.877 0.871 . . . . 0.0 109.474 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.2 -67.97 1.43 Allowed Glycine 0 CA--C 1.528 0.844 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 -169.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.84 123.26 19.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 59.9 p -65.44 162.33 18.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.364 0.602 . . . . 0.0 110.262 175.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -55.16 -42.63 73.35 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 169.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -50.61 -57.45 8.19 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.834 0.854 . . . . 0.0 110.485 173.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -56.0 -49.12 74.51 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.155 -0.34 . . . . 0.0 111.29 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -60.37 -40.88 92.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.173 -179.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -58.37 -52.02 67.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 118.1 0.409 . . . . 0.0 110.748 172.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -50.78 -49.47 58.2 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.564 0.62 . . . . 0.0 110.595 177.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.25 -45.08 93.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 122.976 0.51 . . . . 0.0 110.395 177.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.04 95.8 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.015 0.926 . . . . 0.0 111.885 178.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -44.38 70.82 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 109.951 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.16 -49.38 71.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.898 -0.501 . . . . 0.0 109.854 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -52.42 -51.44 59.1 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.274 0.63 . . . . 0.0 110.357 175.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -52.87 -53.17 52.89 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.839 0.455 . . . . 0.0 111.211 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -53.88 -53.82 47.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.947 0.499 . . . . 0.0 109.848 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -59.62 -39.19 83.48 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.812 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -73.57 60.61 0.67 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.37 0.532 . . . . 0.0 109.97 171.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.8 p -51.25 -42.22 60.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.945 1.298 . . . . 0.0 111.58 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.17 -21.59 64.89 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.71 35.98 74.61 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -174.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.3 m -72.11 -15.49 61.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 117.5 0.65 . . . . 0.0 112.374 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.66 -40.13 2.6 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 109.851 -1.3 . . . . 0.0 109.851 -172.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.0 p -116.19 142.25 47.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.395 1.478 . . . . 0.0 109.06 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.0 mt -74.36 124.19 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.078 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -71.53 147.07 48.07 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.009 0.822 . . . . 0.0 110.193 172.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.0 -49.4 0.82 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.158 0.983 . . . . 0.0 113.317 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -58.46 -46.18 87.12 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.845 -0.534 . . . . 0.0 111.163 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.54 -39.36 93.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.67 0.388 . . . . 0.0 110.192 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.05 -44.3 96.98 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.757 -0.59 . . . . 0.0 110.016 175.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -58.54 -46.84 85.99 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.44 -0.787 . . . . 0.0 110.918 175.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.0 t -52.7 -51.9 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 118.3 0.5 . . . . 0.0 110.113 171.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.03 -53.86 43.95 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.837 0.455 . . . . 0.0 110.594 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.8 mtm -60.47 -41.45 94.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.153 0.581 . . . . 0.0 111.666 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.65 -48.36 79.67 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.22 -37.95 81.89 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.16 0.584 . . . . 0.0 111.626 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.0 mt -69.5 -1.31 8.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.202 1.001 . . . . 0.0 111.936 173.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.33 8.26 74.95 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.49 1.043 . . . . 0.0 112.504 174.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -73.79 162.63 28.92 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.557 1.178 . . . . 0.0 109.1 -177.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -104.73 91.76 4.49 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 170.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.35 75.48 2.41 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.14 1.893 . . . . 0.0 112.794 -173.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -64.85 123.08 18.45 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.716 0.806 . . . . 0.0 109.736 171.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -42.16 -59.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.83 1.652 . . . . 0.0 113.298 -169.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.2 mp0 -61.26 -49.87 75.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.365 0.602 . . . . 0.0 109.999 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.7 mp0 -57.83 -47.27 83.14 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.159 0.984 . . . . 0.0 109.452 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.6 mm -61.97 -46.67 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 122.804 0.441 . . . . 0.0 110.897 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.7 mttp -56.53 -48.73 76.65 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.561 0.618 . . . . 0.0 110.141 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -57.07 -56.31 23.38 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.41 0.284 . . . . 0.0 110.421 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 2.2 tmt? -49.67 -57.66 6.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.395 1.478 . . . . 0.0 110.995 178.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.1 mt -51.67 -50.94 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 C-N-CA 123.233 0.613 . . . . 0.0 109.66 177.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.7 m -57.87 -46.19 85.24 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.551 0.614 . . . . 0.0 111.825 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -57.23 -46.25 83.14 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 117.841 0.292 . . . . 0.0 110.931 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.72 -34.66 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 122.336 -0.228 . . . . 0.0 111.285 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 61.6 t0 -77.01 75.91 3.58 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.331 0.652 . . . . 0.0 111.014 -170.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -67.84 -48.71 65.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.162 0.585 . . . . 0.0 110.822 173.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -128.43 -27.08 2.69 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.728 1.211 . . . . 0.0 112.689 -169.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.89 -17.22 50.16 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 123.48 0.562 . . . . 0.0 114.496 -171.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.4 m 49.66 62.05 2.84 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.296 1.438 . . . . 0.0 112.174 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.28 -29.76 10.26 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 p -102.85 175.67 5.41 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 32.4 mm -125.52 118.59 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 C-N-CA 125.938 1.695 . . . . 0.0 106.945 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -73.5 158.88 34.07 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.963 0.905 . . . . 0.0 110.679 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -48.8 -48.18 41.55 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 123.246 0.618 . . . . 0.0 111.551 175.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -59.85 -48.32 82.15 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.393 0.542 . . . . 0.0 110.877 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -58.01 -47.25 83.62 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.923 0.489 . . . . 0.0 109.848 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -58.06 -49.38 77.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.324 0.65 . . . . 0.0 111.223 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.39 -47.33 79.17 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.605 0.762 . . . . 0.0 109.041 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.1 m -57.17 -52.16 66.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.897 0.479 . . . . 0.0 110.397 177.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -52.64 -53.99 39.43 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.979 0.911 . . . . 0.0 110.222 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.8 tpt -54.59 -54.15 45.16 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.829 0.852 . . . . 0.0 109.681 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.6 m -53.25 -48.43 68.24 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.139 0.576 . . . . 0.0 110.337 178.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.77 -12.62 11.24 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -60.44 -30.57 69.73 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.407 1.003 . . . . 0.0 111.095 171.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 20.4 ptt? . . . . . 0 C--O 1.25 1.125 0 CA-C-O 116.895 -1.526 . . . . 0.0 110.233 171.351 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.3 m -68.45 140.22 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 172.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 169.15 -158.52 31.08 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 108.535 -1.826 . . . . 0.0 108.535 -174.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 50.8 mt -102.16 104.33 14.92 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.87 0.868 . . . . 0.0 109.633 174.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.0 p -64.8 166.78 8.44 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.304 0.574 . . . . 0.0 109.929 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -52.9 -45.65 67.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 121.768 -0.583 . . . . 0.0 109.947 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -51.09 -56.84 10.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.681 0.792 . . . . 0.0 110.214 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.55 -44.35 72.8 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 119.563 -0.256 . . . . 0.0 111.056 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -60.79 -39.56 89.35 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.73 0.695 . . . . 0.0 111.834 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -61.81 -49.61 75.64 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.657 0.662 . . . . 0.0 109.42 175.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -53.44 -48.89 68.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.622 0.369 . . . . 0.0 110.459 177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -57.49 -44.91 85.66 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.937 0.895 . . . . 0.0 110.365 176.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -59.3 -51.65 69.02 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.438 0.563 . . . . 0.0 110.944 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -57.59 -47.38 82.29 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.055 -0.403 . . . . 0.0 110.596 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.94 -52.81 59.44 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.777 0.431 . . . . 0.0 110.306 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.12 -54.84 21.41 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-O 121.302 0.573 . . . . 0.0 110.469 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.16 -49.77 71.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.984 0.914 . . . . 0.0 110.424 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 tt -57.03 -53.25 60.23 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.066 0.547 . . . . 0.0 110.502 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -59.5 -34.37 72.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.265 -176.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.04 58.48 0.49 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.516 0.598 . . . . 0.0 110.536 170.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 69.3 p -54.91 -38.3 67.45 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.58 1.152 . . . . 0.0 110.998 178.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -65.43 -19.16 65.82 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.427 0.691 . . . . 0.0 112.238 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.32 32.23 83.45 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-N 118.565 0.62 . . . . 0.0 111.555 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.74 -15.54 60.77 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.932 0.893 . . . . 0.0 112.249 -178.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.57 -39.73 2.84 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -174.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -106.18 145.06 32.0 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.284 1.433 . . . . 0.0 108.561 171.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.3 mt -78.0 121.0 29.84 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.67 146.57 54.64 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.971 0.805 . . . . 0.0 110.427 174.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.94 -48.93 1.64 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.784 0.834 . . . . 0.0 113.023 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -60.64 -45.14 95.2 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.994 0.518 . . . . 0.0 111.23 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -60.28 -42.45 95.46 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -61.64 -43.15 99.4 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.566 0.621 . . . . 0.0 110.487 176.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -59.03 -47.64 84.5 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.553 -0.717 . . . . 0.0 110.864 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.33 -42.42 80.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 122.895 0.478 . . . . 0.0 110.595 171.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.84 -54.98 40.77 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.575 -0.703 . . . . 0.0 110.252 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 63.3 mtm -56.46 -47.29 79.5 Favored 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 123.359 0.664 . . . . 0.0 110.736 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -49.81 -55.05 15.63 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.388 0.275 . . . . 0.0 110.591 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.35 81.65 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.615 0.766 . . . . 0.0 111.624 179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.0 mt -66.66 -6.32 15.07 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.33 1.052 . . . . 0.0 112.053 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 94.28 15.92 45.74 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 118.983 0.811 . . . . 0.0 112.449 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -76.45 165.94 24.11 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.126 0.963 . . . . 0.0 109.437 172.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -113.57 97.9 45.25 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 105.445 -2.057 . . . . 0.0 105.445 169.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -54.47 88.28 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.837 3.025 . . . . 0.0 115.208 -173.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -66.52 82.38 0.1 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.069 0.948 . . . . 0.0 109.828 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -30.96 -58.49 0.22 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.605 2.362 . . . . 0.0 114.44 -170.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -62.29 -51.33 68.1 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 121.856 -0.528 . . . . 0.0 110.568 -174.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -59.84 -44.73 93.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.521 0.728 . . . . 0.0 110.145 178.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.2 mm -53.2 -54.57 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.911 0.884 . . . . 0.0 109.924 175.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -57.61 -48.37 79.6 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.825 0.45 . . . . 0.0 110.898 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -55.84 -55.18 35.5 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 117.696 0.226 . . . . 0.0 110.499 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 48.7 ttp -53.35 -55.26 26.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.29 0.636 . . . . 0.0 110.238 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.3 mt -49.02 -50.54 14.39 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 123.219 0.608 . . . . 0.0 109.598 177.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.3 m -58.51 -48.31 81.26 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.47 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -57.88 -42.35 84.4 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.767 0.427 . . . . 0.0 111.362 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 51.6 mm -74.07 -34.46 38.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-N 117.966 0.348 . . . . 0.0 111.031 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -76.5 75.45 3.23 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.472 1.109 . . . . 0.0 110.029 -177.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -56.23 -21.92 26.4 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -172.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -109.59 6.18 23.69 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.19 0.905 . . . . 0.0 111.349 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 51.08 40.95 44.94 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.866 1.222 . . . . 0.0 113.264 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.0 p -78.43 -14.92 59.16 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 112.779 -178.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 85.77 9.63 77.63 Favored Glycine 0 CA--C 1.534 1.259 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -168.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.7 p -138.74 159.23 42.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.66 0.784 . . . . 0.0 110.396 -173.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.9 mm -111.49 120.38 61.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.358 1.463 . . . . 0.0 108.299 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.37 153.94 35.34 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.31 0.644 . . . . 0.0 110.397 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -50.66 -43.37 57.28 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.346 0.658 . . . . 0.0 112.34 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -60.9 -45.61 93.93 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.472 0.578 . . . . 0.0 110.759 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -62.14 -46.85 87.15 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -56.41 -50.42 71.67 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.774 0.83 . . . . 0.0 110.877 176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.3 tp -57.62 -44.64 85.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.44 0.696 . . . . 0.0 109.995 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.4 m -58.54 -50.07 75.11 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.951 -0.468 . . . . 0.0 110.378 176.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -54.98 -47.0 75.16 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.838 0.855 . . . . 0.0 110.521 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.4 mmt -56.21 -55.95 26.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.135 -0.353 . . . . 0.0 110.521 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -52.92 -39.21 62.63 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.071 0.948 . . . . 0.0 111.504 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.41 -37.96 73.57 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.457 0.303 . . . . 0.0 111.589 177.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -81.58 -49.86 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.102 0.41 . . . . 0.0 110.544 177.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . 0.273 3.6 ppp? . . . . . 0 C--O 1.251 1.136 0 C-N-CA 127.438 2.295 . . . . 0.0 114.066 -171.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 120.957 0.408 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.464 HG22 ' H ' ' A' ' 3' ' ' GLY . 12.8 p -68.93 179.0 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 169.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.464 ' H ' HG22 ' A' ' 2' ' ' VAL . . . -42.68 -34.38 1.79 Allowed Glycine 0 CA--C 1.532 1.15 0 C-N-CA 124.911 1.243 . . . . 0.0 113.471 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 39.4 mt -83.96 100.83 11.28 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.907 0.883 . . . . 0.0 110.169 169.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.2 p -64.74 168.87 5.61 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -52.18 -45.76 65.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.884 -0.51 . . . . 0.0 110.58 172.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -53.29 -55.69 22.58 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.711 0.805 . . . . 0.0 110.389 176.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -55.05 -44.31 74.59 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-O 119.488 -0.292 . . . . 0.0 110.563 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -60.0 -39.25 85.12 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.818 0.735 . . . . 0.0 111.659 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -62.16 -50.27 72.51 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.188 0.903 . . . . 0.0 109.721 176.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -53.48 -49.61 67.1 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.033 0.445 . . . . 0.0 110.172 177.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 74.3 mt -60.89 -41.34 88.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.49 1.116 . . . . 0.0 110.435 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.1 tpt180 -62.11 -47.14 85.91 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.878 0.763 . . . . 0.0 110.683 175.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -55.95 -54.68 41.82 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.73 -49.23 68.59 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.165 0.586 . . . . 0.0 110.446 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -52.22 -56.08 17.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.894 0.878 . . . . 0.0 110.702 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -54.5 -49.97 68.92 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.371 0.668 . . . . 0.0 110.583 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -56.39 -53.85 52.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.198 0.199 . . . . 0.0 110.607 178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -60.19 -35.17 74.77 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.454 0.302 . . . . 0.0 111.065 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -72.35 58.47 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.218 0.607 . . . . 0.0 110.421 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 70.2 p -55.41 -36.95 67.0 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 110.967 177.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -65.64 -17.65 64.75 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.379 0.672 . . . . 0.0 112.401 177.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.93 31.14 79.95 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.773 0.715 . . . . 0.0 111.984 -178.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.81 5.45 25.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.89 1.276 . . . . 0.0 112.844 -179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.4 12.08 37.38 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.499 1.523 . . . . 0.0 111.915 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 42.5 p -156.63 135.32 11.64 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 104.751 -2.315 . . . . 0.0 104.751 -169.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.1 mt -85.07 116.25 28.23 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.093 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -63.88 144.24 57.22 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.82 0.737 . . . . 0.0 109.767 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.21 -46.31 1.48 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 174.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -54.99 -52.65 62.43 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.385 0.674 . . . . 0.0 111.019 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -58.19 -38.92 77.66 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.026 0.531 . . . . 0.0 109.912 177.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.2 tp -65.37 -45.69 83.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.512 0.596 . . . . 0.0 111.551 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.282 20.3 pttp -62.28 -39.4 92.81 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.88 -1.137 . . . . 0.0 111.673 175.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.0 t -55.8 -50.35 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.346 0.521 . . . . 0.0 110.151 171.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -53.03 57.88 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.875 0.87 . . . . 0.0 110.309 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 66.9 mtm -57.28 -42.21 81.21 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.736 0.414 . . . . 0.0 111.421 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -56.15 18.01 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 172.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.79 -39.12 73.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.197 0.599 . . . . 0.0 112.003 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.1 mt -70.64 -6.79 39.53 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.53 1.132 . . . . 0.0 112.539 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.4 22.61 36.81 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 119.456 1.025 . . . . 0.0 112.774 175.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -76.19 -179.2 4.88 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.211 1.005 . . . . 0.0 109.916 174.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -123.36 102.87 36.04 Favored Pre-proline 0 N--CA 1.452 -0.359 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 169.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -59.96 69.8 0.07 OUTLIER 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 124.021 3.147 . . . . 0.0 115.699 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -67.49 88.84 0.22 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -32.15 -49.33 0.19 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.0 2.12 . . . . 0.0 115.074 -173.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -60.98 -48.27 82.6 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.571 0.623 . . . . 0.0 111.144 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -68.53 -42.43 78.5 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.457 0.703 . . . . 0.0 109.577 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 mm -52.72 -57.69 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 123.329 0.651 . . . . 0.0 109.336 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -54.68 -51.05 66.74 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 123.805 0.842 . . . . 0.0 110.475 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -54.16 -57.92 9.33 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.197 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 46.3 ttp -56.92 -53.04 62.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.494 0.317 . . . . 0.0 110.254 -177.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.4 mt -50.19 -49.79 21.84 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.299 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.2 m -58.3 -48.39 80.64 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.372 0.533 . . . . 0.0 111.482 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -57.72 -45.07 86.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.424 0.29 . . . . 0.0 111.401 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 37.4 mm -71.69 -33.62 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 122.206 -0.308 . . . . 0.0 110.832 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -75.81 69.84 2.51 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.03 0.932 . . . . 0.0 110.163 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.95 -41.89 92.88 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.586 1.154 . . . . 0.0 110.875 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -142.48 -27.49 0.61 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.306 1.042 . . . . 0.0 113.658 -169.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.1 -13.2 26.48 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.216 0.846 . . . . 0.0 115.216 -172.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m 50.13 65.73 1.35 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.488 1.515 . . . . 0.0 112.849 169.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.96 -25.13 26.76 Favored Glycine 0 CA--C 1.528 0.846 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -178.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 18.5 p -106.63 167.71 9.67 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.9 mm -121.04 113.7 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 125.775 1.63 . . . . 0.0 106.804 173.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -71.56 159.32 34.66 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.402 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -50.94 -43.86 60.25 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.259 0.624 . . . . 0.0 112.03 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -59.91 -48.52 81.35 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.387 0.54 . . . . 0.0 110.722 178.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -60.11 -47.44 85.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.852 0.461 . . . . 0.0 109.931 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -56.88 -50.37 72.69 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.755 0.822 . . . . 0.0 110.456 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.2 tt -58.64 -44.17 89.97 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.389 0.676 . . . . 0.0 109.88 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.0 m -56.97 -49.61 75.19 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.907 -0.496 . . . . 0.0 110.221 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 61.2 ttp -52.67 -50.94 62.25 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.9 mmt -59.5 -42.24 91.73 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.6 m -59.55 -47.66 84.67 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.428 0.691 . . . . 0.0 109.989 177.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.64 -44.99 93.3 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.746 0.418 . . . . 0.0 110.97 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -66.21 -45.11 81.9 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.273 0.229 . . . . 0.0 111.289 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 35.3 ttp . . . . . 0 C--O 1.25 1.126 0 C-N-CA 125.971 1.708 . . . . 0.0 109.252 -169.79 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.0 mtt85 . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 110.783 -0.08 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.39 59.61 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.665 0.786 . . . . 0.0 109.614 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 73.61 -61.76 1.97 Allowed Glycine 0 CA--C 1.53 0.988 0 N-CA-C 109.279 -1.529 . . . . 0.0 109.279 -169.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.87 114.02 3.4 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.908 0.883 . . . . 0.0 110.356 174.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 52.9 p -70.07 170.17 11.98 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 169.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -55.77 -36.75 67.69 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 121.745 -0.597 . . . . 0.0 110.519 169.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -68.95 -46.36 68.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.668 -0.645 . . . . 0.0 109.562 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.39 -43.06 88.37 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.457 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.37 -45.78 92.29 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.921 0.782 . . . . 0.0 111.166 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -54.36 -54.3 42.35 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.15 0.432 . . . . 0.0 110.232 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -54.25 -46.78 72.69 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.257 0.623 . . . . 0.0 111.054 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 78.0 mt -59.59 -45.97 93.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.307 0.643 . . . . 0.0 110.3 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -60.15 -45.94 91.37 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.653 -0.655 . . . . 0.0 110.879 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -57.19 -51.72 68.2 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.072 0.549 . . . . 0.0 110.323 176.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -49.39 72.03 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.84 0.456 . . . . 0.0 110.691 177.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -52.79 -57.17 11.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.48 0.712 . . . . 0.0 110.263 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -52.46 -50.56 62.41 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.241 1.016 . . . . 0.0 110.836 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 tt -57.23 -54.71 43.73 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -59.86 -33.58 71.99 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 122.424 -0.172 . . . . 0.0 111.044 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -72.51 51.55 0.26 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.449 1.099 . . . . 0.0 110.796 172.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 66.4 p -52.85 -37.09 59.81 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.934 1.294 . . . . 0.0 111.618 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.33 -22.04 66.82 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.558 0.743 . . . . 0.0 112.639 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.79 22.8 73.98 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 121.723 -0.611 . . . . 0.0 111.761 -175.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.1 p -75.11 -10.86 59.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.713 1.605 . . . . 0.0 112.616 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.6 14.62 50.85 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.24 0.924 . . . . 0.0 111.854 -173.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.7 p -155.48 120.55 4.84 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 104.553 -2.388 . . . . 0.0 104.553 -173.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -78.95 122.19 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.152 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -71.67 145.32 48.97 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 174.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.99 -48.24 0.76 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.615 1.166 . . . . 0.0 113.052 172.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -58.75 -48.62 80.58 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.021 0.528 . . . . 0.0 111.111 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -59.99 -42.47 94.29 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.027 -0.421 . . . . 0.0 109.888 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -62.64 -40.86 98.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.947 -0.471 . . . . 0.0 110.534 177.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -60.23 -47.76 84.59 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.549 -0.719 . . . . 0.0 110.149 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.6 t -54.55 -48.97 69.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 CA-C-N 118.216 0.462 . . . . 0.0 110.2 173.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.75 -51.17 64.23 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 122.163 -0.336 . . . . 0.0 110.592 176.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.9 mtm -59.21 -42.09 90.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.377 0.671 . . . . 0.0 111.948 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -57.69 -49.41 76.6 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.516 0.598 . . . . 0.0 110.018 172.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.95 -39.15 77.39 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.947 -0.471 . . . . 0.0 111.63 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -72.37 -1.88 17.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.528 1.131 . . . . 0.0 112.337 175.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 27.12 72.11 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-N 119.054 0.843 . . . . 0.0 112.373 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -80.78 164.07 23.01 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -106.05 92.51 6.62 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 107.634 -1.246 . . . . 0.0 107.634 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -75.8 75.84 3.91 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.115 1.876 . . . . 0.0 112.227 -169.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -62.14 98.68 0.11 Allowed 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 124.692 1.197 . . . . 0.0 110.128 174.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.2 mttm -31.71 -57.09 0.28 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.314 2.245 . . . . 0.0 113.867 -174.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -51.71 -49.88 61.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.234 0.614 . . . . 0.0 111.176 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -70.5 -41.75 72.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 mm -57.0 -46.77 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 123.141 0.576 . . . . 0.0 110.995 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -55.52 -51.54 66.66 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.297 0.499 . . . . 0.0 110.421 177.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -59.37 -51.42 69.98 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.291 -0.255 . . . . 0.0 110.695 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 25.8 ttp -50.0 -56.79 9.29 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.535 0.734 . . . . 0.0 109.974 177.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -50.65 -49.72 24.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 C-N-CA 123.526 0.73 . . . . 0.0 109.563 177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 p -58.56 -47.02 85.63 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.479 0.581 . . . . 0.0 111.219 -178.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -60.56 -43.42 97.28 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.642 0.777 . . . . 0.0 110.903 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.5 mm -71.53 -34.15 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 O-C-N 122.218 -0.301 . . . . 0.0 110.766 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 58.3 t0 -78.47 67.31 4.22 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 121.586 -0.696 . . . . 0.0 110.559 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -47.35 -33.09 5.43 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.921 1.688 . . . . 0.0 113.028 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -97.86 9.44 42.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.849 1.26 . . . . 0.0 109.923 -173.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 35.85 40.74 0.36 Allowed Glycine 0 CA--C 1.528 0.853 0 C-N-CA 127.428 2.442 . . . . 0.0 114.173 -175.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.1 m -89.29 19.38 4.41 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.222 0.609 . . . . 0.0 112.366 -170.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 55.97 18.52 19.21 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 124.756 1.17 . . . . 0.0 112.973 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.4 p -161.32 161.56 30.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 -170.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.8 mm -99.88 110.09 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.18 158.07 36.47 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.578 0.751 . . . . 0.0 110.299 170.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.46 -47.74 38.1 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.707 0.803 . . . . 0.0 112.24 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.51 -40.73 95.65 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.356 0.525 . . . . 0.0 110.733 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -65.6 -45.93 81.29 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.713 -0.476 . . . . 0.0 109.713 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -57.32 -47.31 81.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.65 0.78 . . . . 0.0 111.1 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.1 tp -57.15 -49.02 77.26 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.527 0.731 . . . . 0.0 109.699 176.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 m -55.67 -48.76 74.5 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.573 0.349 . . . . 0.0 110.257 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 28.0 ttt -52.95 -54.1 39.95 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.868 0.867 . . . . 0.0 110.23 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.1 mmt -54.96 -49.67 70.81 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 122.056 -0.403 . . . . 0.0 111.087 176.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.8 m -56.96 -37.24 71.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.288 0.635 . . . . 0.0 110.989 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.33 -44.37 65.23 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.897 -0.502 . . . . 0.0 111.278 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -63.82 -46.86 83.17 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 122.729 0.411 . . . . 0.0 112.007 -177.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.8 ptm . . . . . 0 C--O 1.252 1.199 0 CA-C-O 116.792 -1.575 . . . . 0.0 112.328 -171.984 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 120.715 0.293 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 43.4 t -72.55 86.72 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 121.322 0.582 . . . . 0.0 109.803 -169.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.76 -63.43 3.77 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.3 mt -72.35 85.66 1.1 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 169.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 71.0 p -63.87 168.93 4.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.89 0.876 . . . . 0.0 109.48 176.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -59.46 -39.64 84.29 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 173.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -52.99 -55.22 25.16 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 124.765 1.226 . . . . 0.0 110.69 169.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -56.53 -49.13 75.68 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.447 -0.783 . . . . 0.0 110.702 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -59.11 -40.08 84.24 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.263 0.483 . . . . 0.0 111.616 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.78 -55.83 27.72 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 118.561 0.619 . . . . 0.0 110.6 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -53.76 -48.58 69.59 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.735 0.302 . . . . 0.0 110.847 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 86.1 mt -58.96 -47.54 89.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 123.915 0.886 . . . . 0.0 110.334 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -58.88 -51.78 68.55 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.145 0.578 . . . . 0.0 110.59 177.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -56.19 -51.54 67.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.054 0.542 . . . . 0.0 110.304 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.33 -51.03 69.75 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 110.814 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -50.18 -58.65 5.13 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.987 0.915 . . . . 0.0 109.706 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -52.81 -51.35 61.17 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.812 0.845 . . . . 0.0 110.252 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tt -56.18 -52.81 63.04 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 122.114 0.166 . . . . 0.0 111.055 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -60.17 -40.65 90.68 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.814 0.34 . . . . 0.0 110.706 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -77.28 40.21 0.27 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.651 1.18 . . . . 0.0 112.552 -171.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 24.4 p -43.93 -67.3 0.29 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.761 1.624 . . . . 0.0 111.653 -174.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -92.13 -25.23 18.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.092 -171.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -70.32 -39.4 70.77 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 177.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.5 m 41.6 58.82 2.63 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.342 1.457 . . . . 0.0 112.594 172.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 154.87 -53.07 0.44 Allowed Glycine 0 CA--C 1.523 0.59 0 N-CA-C 108.71 -1.756 . . . . 0.0 108.71 -175.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.1 p -137.74 130.89 30.48 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.319 0.648 . . . . 0.0 109.684 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.9 mt -73.76 112.2 10.04 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -176.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -62.42 146.83 50.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.057 0.39 . . . . 0.0 110.037 172.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.91 -48.0 0.73 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.043 0.937 . . . . 0.0 113.067 172.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -58.78 -46.75 86.82 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.176 0.59 . . . . 0.0 111.441 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.94 -39.76 93.21 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.862 -0.523 . . . . 0.0 109.644 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.3 tp -62.51 -43.21 99.37 Favored 'General case' 0 CA--C 1.532 0.262 0 O-C-N 121.82 -0.55 . . . . 0.0 110.518 174.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -58.2 -48.19 81.11 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.459 -0.775 . . . . 0.0 110.478 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.35 -48.47 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 122.183 -0.323 . . . . 0.0 110.294 174.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -50.39 66.62 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 122.678 0.391 . . . . 0.0 110.635 177.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.4 mtm -59.99 -42.42 94.18 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.437 0.695 . . . . 0.0 111.359 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -57.37 -46.74 83.07 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.893 0.77 . . . . 0.0 111.087 171.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.41 -38.23 76.98 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.754 -0.591 . . . . 0.0 111.479 175.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.2 mt -73.16 0.01 12.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.471 1.108 . . . . 0.0 112.456 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 20.3 71.95 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 124.184 0.897 . . . . 0.0 113.021 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -76.78 160.37 29.35 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.042 0.921 . . . . 0.0 109.755 177.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -107.18 108.31 61.71 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 169.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -56.3 76.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 124.445 3.43 . . . . 0.0 115.201 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 11.7 mmmm -65.7 80.38 0.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.958 1.303 . . . . 0.0 108.855 169.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -31.86 -52.51 0.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.208 2.203 . . . . 0.0 115.07 -170.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -63.33 -45.37 91.59 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.519 -0.738 . . . . 0.0 111.379 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.76 -43.57 88.46 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.7 mm -55.76 -48.29 78.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.055 0.542 . . . . 0.0 109.897 174.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -49.79 76.46 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.799 -0.563 . . . . 0.0 110.87 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -54.91 -56.04 23.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.802 0.273 . . . . 0.0 110.532 177.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.6 ttt -47.7 -62.46 1.44 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.183 1.393 . . . . 0.0 110.187 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.1 mt -50.72 -49.05 26.95 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 123.088 0.555 . . . . 0.0 109.62 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -58.61 -49.85 75.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.552 0.615 . . . . 0.0 111.601 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -56.81 -44.65 82.2 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.864 0.466 . . . . 0.0 111.042 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 30.5 mm -71.85 -34.58 51.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 O-C-N 122.325 -0.234 . . . . 0.0 111.011 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -76.86 73.24 3.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.776 0.83 . . . . 0.0 110.263 -175.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -56.39 -45.71 80.46 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.522 0.729 . . . . 0.0 111.136 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -145.71 -27.04 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.331 1.052 . . . . 0.0 113.107 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.05 -11.75 6.48 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 115.925 1.13 . . . . 0.0 115.925 -173.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.2 m 49.67 70.01 0.54 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.706 1.602 . . . . 0.0 113.175 169.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.09 -23.21 25.24 Favored Glycine 0 CA--C 1.529 0.92 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -108.66 159.98 16.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.0 mm -116.99 108.79 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 126.193 1.797 . . . . 0.0 106.742 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -69.09 155.99 39.42 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.778 0.831 . . . . 0.0 110.139 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -46.33 -47.01 18.55 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.184 0.594 . . . . 0.0 112.155 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -58.48 -43.84 89.14 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.674 0.67 . . . . 0.0 110.779 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -65.12 -43.14 92.95 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -58.41 -49.0 78.83 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.406 0.622 . . . . 0.0 110.495 176.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.9 tt -58.17 -42.47 86.08 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.305 0.642 . . . . 0.0 110.027 175.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 m -56.89 -47.5 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.525 0.602 . . . . 0.0 110.288 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 16.1 tmm? -55.38 -48.21 74.65 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.101 -0.374 . . . . 0.0 110.664 175.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 23.3 mmt -57.36 -47.47 81.53 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 122.119 -0.363 . . . . 0.0 110.322 177.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.5 m -57.32 -46.33 83.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.783 0.833 . . . . 0.0 110.269 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.83 -43.08 99.56 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.917 0.487 . . . . 0.0 111.012 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -66.24 -45.56 80.18 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.459 0.303 . . . . 0.0 111.178 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 tpp . . . . . 0 C--O 1.251 1.165 0 CA-C-O 116.946 -1.502 . . . . 0.0 111.095 -175.126 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.3 m -47.86 118.55 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 123.305 0.642 . . . . 0.0 109.838 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 128.73 -44.6 1.21 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 -169.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 48.6 mt -76.07 86.04 2.95 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.985 0.514 . . . . 0.0 109.805 177.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 51.7 p -64.69 161.78 17.13 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.583 0.753 . . . . 0.0 110.575 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -48.59 -41.2 30.03 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.061 0.944 . . . . 0.0 111.351 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.4 mp0 -53.01 -53.6 47.67 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.939 0.896 . . . . 0.0 110.14 174.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.55 -40.23 93.94 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 119.507 -0.282 . . . . 0.0 110.52 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -55.41 -46.24 76.63 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.522 0.601 . . . . 0.0 110.561 173.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -58.63 -50.79 72.55 Favored 'General case' 0 C--O 1.225 -0.19 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -53.76 -48.31 69.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.524 0.33 . . . . 0.0 111.243 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.13 -46.54 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.171 0.588 . . . . 0.0 109.676 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -61.34 -44.59 96.93 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.895 -0.503 . . . . 0.0 111.417 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -56.78 -50.46 72.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.706 -0.621 . . . . 0.0 110.006 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.31 69.16 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.466 0.306 . . . . 0.0 110.575 176.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -51.28 -57.66 8.26 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.453 0.701 . . . . 0.0 111.078 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -56.74 -46.95 81.05 Favored 'General case' 0 C--O 1.227 -0.095 0 C-N-CA 123.142 0.577 . . . . 0.0 110.674 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.1 tt -56.1 -52.81 62.98 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.497 0.319 . . . . 0.0 110.248 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -60.06 -40.43 89.46 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.51 -0.182 . . . . 0.0 110.51 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -72.56 59.97 0.46 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.709 0.404 . . . . 0.0 110.808 170.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 62.8 p -51.81 -37.99 53.92 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.774 1.23 . . . . 0.0 111.275 176.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -65.98 -22.62 66.48 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.248 0.619 . . . . 0.0 112.241 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.9 34.42 77.09 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.2 m -67.55 -20.18 65.38 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.824 0.812 . . . . 0.0 112.09 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.48 1.19 75.03 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.045 1.307 . . . . 0.0 110.375 -169.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 79.0 p -151.77 149.52 29.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.366 2.266 . . . . 0.0 106.498 -171.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 73.7 mt -86.71 115.76 28.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -64.95 145.9 55.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 119.269 0.94 . . . . 0.0 110.651 174.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.6 -50.04 1.13 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.927 0.891 . . . . 0.0 113.069 173.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -54.36 -53.68 50.64 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.693 0.797 . . . . 0.0 110.655 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -58.71 -37.56 76.41 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.628 0.771 . . . . 0.0 110.412 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.1 tp -67.07 -46.61 73.78 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.885 -0.509 . . . . 0.0 110.876 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.283 21.1 pttp -63.65 -36.03 82.5 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.487 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.4 t -57.38 -48.57 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 118.286 0.494 . . . . 0.0 110.502 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.85 -50.66 65.74 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 121.834 -0.541 . . . . 0.0 110.003 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 19.0 mtm -57.12 -45.77 83.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.68 177.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -54.19 -50.56 66.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.863 0.756 . . . . 0.0 110.48 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.92 -40.25 75.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.123 -0.361 . . . . 0.0 111.219 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.5 mt -74.25 1.76 10.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.264 1.026 . . . . 0.0 112.798 175.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.95 20.17 65.9 Favored Glycine 0 CA--C 1.529 0.963 0 CA-C-N 119.181 0.901 . . . . 0.0 113.292 174.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -77.77 163.1 26.43 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.149 0.974 . . . . 0.0 109.506 170.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -109.02 108.18 60.44 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.79 76.11 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 124.597 3.531 . . . . 0.0 115.669 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.41 84.01 0.16 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -31.48 -57.87 0.26 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 127.426 2.291 . . . . 0.0 114.067 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.71 -44.74 81.87 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.675 -0.641 . . . . 0.0 111.634 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -71.0 -39.02 72.68 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.8 mm -54.02 -49.15 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 171.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.0 mmmm -58.81 -49.75 76.53 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.963 -0.541 . . . . 0.0 111.386 177.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -52.32 -58.16 7.52 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.529 0.604 . . . . 0.0 110.103 177.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 22.7 ttt -49.03 -60.93 2.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.921 1.288 . . . . 0.0 110.16 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.7 mt -50.48 -49.05 25.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 C-N-CA 122.967 0.507 . . . . 0.0 109.71 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.5 m -58.83 -49.27 78.33 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.333 0.515 . . . . 0.0 111.581 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -57.04 -45.04 83.48 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.715 0.234 . . . . 0.0 111.203 178.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.1 mm -72.0 -34.33 50.34 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 O-C-N 122.034 -0.416 . . . . 0.0 111.02 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -78.42 74.01 4.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.886 0.874 . . . . 0.0 110.404 -174.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.44 -47.31 86.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.061 0.545 . . . . 0.0 111.133 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -134.75 -32.63 0.98 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.484 1.114 . . . . 0.0 112.861 -169.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.82 -8.4 4.23 Favored Glycine 0 CA--C 1.54 1.633 0 N-CA-C 116.421 1.329 . . . . 0.0 116.421 -171.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.7 m 44.88 69.69 0.41 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.051 1.741 . . . . 0.0 113.674 169.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 95.32 -21.93 41.56 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.369 -0.693 . . . . 0.0 111.369 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.2 p -112.04 161.42 16.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 41.8 mm -104.82 123.13 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 124.914 1.285 . . . . 0.0 107.65 173.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -74.79 161.15 29.86 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.756 0.823 . . . . 0.0 110.105 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -58.08 -46.81 84.83 Favored 'General case' 0 C--O 1.226 -0.155 0 O-C-N 121.955 -0.466 . . . . 0.0 111.573 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -57.91 -46.62 84.69 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.946 0.339 . . . . 0.0 110.951 178.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -58.73 -51.4 70.1 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.073 0.549 . . . . 0.0 109.985 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -54.74 -51.95 64.05 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.51 0.724 . . . . 0.0 110.822 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -54.58 -48.71 71.77 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.241 0.617 . . . . 0.0 109.908 178.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.3 m -56.61 -49.55 74.62 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.403 0.281 . . . . 0.0 110.532 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 54.6 ttp -54.82 -53.25 57.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.771 0.829 . . . . 0.0 110.62 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 92.5 mmm -58.85 -45.53 89.87 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.137 0.575 . . . . 0.0 110.441 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.3 m -58.98 -44.19 91.52 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.879 0.472 . . . . 0.0 110.624 178.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.14 -58.96 5.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -83.14 48.77 1.42 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.192 0.597 . . . . 0.0 110.965 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 15.2 ptp . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.647 -1.168 . . . . 0.0 110.776 176.663 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 61.0 ttm-85 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 120.537 0.208 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.0 p -156.87 157.11 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 159.43 -58.27 0.33 Allowed Glycine 0 CA--C 1.523 0.563 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 93.5 mt -129.22 85.0 2.27 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.456 1.502 . . . . 0.0 108.503 175.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 64.7 p -65.6 159.89 23.73 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.034 0.445 . . . . 0.0 110.35 174.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -54.1 -36.84 63.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.106 0.479 . . . . 0.0 110.286 171.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.5 mp0 -61.94 -51.45 68.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 121.528 -0.732 . . . . 0.0 109.682 176.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -53.47 -47.3 69.91 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.143 0.428 . . . . 0.0 110.712 174.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -55.79 -48.06 76.02 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.554 0.616 . . . . 0.0 111.243 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -56.15 -51.25 68.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.778 0.431 . . . . 0.0 110.883 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -55.13 -51.14 67.38 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.261 0.624 . . . . 0.0 110.8 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.5 mt -58.76 -46.58 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.16 0.584 . . . . 0.0 109.725 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -59.39 -47.39 85.65 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.895 -0.503 . . . . 0.0 110.852 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -56.33 -53.17 60.52 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.086 0.554 . . . . 0.0 110.271 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.68 -48.94 71.79 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.646 0.378 . . . . 0.0 110.587 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -52.7 -57.62 9.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.936 0.895 . . . . 0.0 110.787 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -56.56 -47.88 78.53 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.413 0.685 . . . . 0.0 110.449 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.35 -53.21 59.05 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.76 0.254 . . . . 0.0 110.365 177.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -60.82 -38.47 85.52 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.987 -178.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.75 61.9 0.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.62 0.645 . . . . 0.0 109.684 170.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 55.7 p -52.67 -38.58 60.72 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.768 1.227 . . . . 0.0 111.369 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -66.48 -22.43 66.19 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.31 34.84 81.18 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 111.326 -0.71 . . . . 0.0 111.326 -175.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 m -67.07 -25.38 66.21 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.593 0.697 . . . . 0.0 111.912 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.6 -20.59 36.57 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.034 1.302 . . . . 0.0 110.547 -169.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 74.6 p -137.78 147.98 45.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.591 1.956 . . . . 0.0 107.562 -177.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.2 mt -80.33 122.89 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.095 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.81 145.53 52.06 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.061 0.846 . . . . 0.0 110.086 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.18 -46.4 2.22 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.924 0.89 . . . . 0.0 113.146 175.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -60.72 -46.27 91.07 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.927 -0.483 . . . . 0.0 111.047 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -60.31 -38.9 85.12 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.8 tp -62.75 -43.4 98.91 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.814 -0.554 . . . . 0.0 110.257 175.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.2 -47.84 82.19 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.563 -0.711 . . . . 0.0 110.34 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.1 t -55.23 -49.23 74.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 O-C-N 122.246 -0.284 . . . . 0.0 110.325 173.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.59 -48.9 68.8 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.974 0.509 . . . . 0.0 110.695 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 72.0 mtm -62.26 -41.4 98.43 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.295 0.638 . . . . 0.0 111.426 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -57.44 -46.08 83.98 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.807 0.731 . . . . 0.0 110.802 170.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.95 -38.44 79.06 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.597 0.635 . . . . 0.0 111.531 175.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.0 mt -71.6 -0.44 10.71 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.198 0.999 . . . . 0.0 112.378 173.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.8 18.87 74.36 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 124.231 0.92 . . . . 0.0 112.66 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.3 m-30 -78.38 160.21 27.92 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.109 0.954 . . . . 0.0 109.623 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -108.21 107.26 60.02 Favored Pre-proline 0 CA--C 1.537 0.472 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 169.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -54.95 75.26 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 124.991 3.794 . . . . 0.0 116.028 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -65.07 85.04 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.495 1.118 . . . . 0.0 108.522 169.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -31.43 -58.16 0.25 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 127.234 2.214 . . . . 0.0 113.878 -171.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -57.56 -46.15 84.27 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.707 -0.621 . . . . 0.0 112.12 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -66.08 -43.22 87.97 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.7 mm -54.06 -53.57 27.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 C-N-CA 123.224 0.61 . . . . 0.0 109.796 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.8 mtpp -56.34 -52.04 66.04 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.188 0.595 . . . . 0.0 110.825 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.02 -58.08 8.66 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -53.64 -54.21 40.92 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.149 0.98 . . . . 0.0 110.534 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.9 mt -51.08 -50.82 23.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.46 -46.96 85.53 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.482 0.583 . . . . 0.0 111.712 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -57.68 -45.37 85.69 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.855 0.462 . . . . 0.0 110.995 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.24 -34.86 55.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.633 0.254 . . . . 0.0 110.608 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -78.87 76.6 5.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.78 0.832 . . . . 0.0 110.275 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -74.74 -51.66 13.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.12 0.568 . . . . 0.0 110.313 172.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -116.94 -25.9 7.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.789 1.636 . . . . 0.0 112.041 -173.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -58.84 -20.36 47.77 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.129 0.871 . . . . 0.0 115.056 -169.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.1 m 50.36 58.76 5.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.028 1.331 . . . . 0.0 111.989 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 97.03 -27.95 16.05 Favored Glycine 0 CA--C 1.53 0.971 0 CA-C-O 119.633 -0.537 . . . . 0.0 111.951 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 50.8 p -102.69 175.21 5.57 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 170.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 35.0 mm -116.09 120.43 64.83 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 172.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.96 158.41 35.53 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.478 1.111 . . . . 0.0 110.542 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -48.99 -52.97 21.92 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 123.075 0.55 . . . . 0.0 111.77 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.8 -38.76 92.28 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 119.006 0.821 . . . . 0.0 111.252 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.5 -49.07 79.03 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.926 -0.483 . . . . 0.0 109.781 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -57.23 -45.73 83.62 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.578 0.751 . . . . 0.0 110.994 175.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.61 -50.37 68.23 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.773 1.229 . . . . 0.0 108.903 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 27.7 m -58.4 -48.74 79.68 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.068 0.547 . . . . 0.0 110.404 178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -54.29 -51.37 64.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.727 0.811 . . . . 0.0 110.187 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 21.1 mmt -55.68 -53.53 55.42 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 122.288 -0.257 . . . . 0.0 110.68 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 m -51.7 -44.93 63.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.226 0.61 . . . . 0.0 110.692 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.95 -27.7 61.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -79.68 -14.62 58.64 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.87 0.759 . . . . 0.0 112.293 177.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 58.7 mtt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 116.977 -1.487 . . . . 0.0 110.712 -178.041 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.614 0.245 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.9 m -79.63 82.69 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 105.367 -2.086 . . . . 0.0 105.367 169.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 58.64 -149.84 36.0 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -169.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.16 76.78 2.99 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.355 1.074 . . . . 0.0 109.577 170.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.4 m -63.56 157.67 23.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.531 169.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -43.95 -49.24 8.57 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 123.877 0.871 . . . . 0.0 111.669 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -49.62 -49.77 45.61 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.269 0.628 . . . . 0.0 111.827 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -64.63 -42.89 95.19 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.76 -0.587 . . . . 0.0 109.981 179.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -59.91 -39.34 85.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 118.471 0.578 . . . . 0.0 111.557 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -59.47 -53.94 52.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.508 0.723 . . . . 0.0 109.711 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -53.89 -49.08 69.37 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 83.6 mt -57.57 -43.51 83.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 124.125 0.97 . . . . 0.0 109.965 177.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -63.25 -44.56 94.83 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.539 -0.725 . . . . 0.0 111.341 177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -56.67 -50.58 71.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.309 0.504 . . . . 0.0 110.145 175.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.12 -52.26 63.83 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.445 0.298 . . . . 0.0 110.372 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -48.98 -54.13 16.94 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.879 0.872 . . . . 0.0 110.641 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.5 -51.53 66.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.472 0.709 . . . . 0.0 110.861 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -52.8 -53.53 47.05 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 177.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -59.89 -38.16 81.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.887 0.475 . . . . 0.0 111.31 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -73.12 62.48 0.65 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 118.128 0.422 . . . . 0.0 110.268 174.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.5 p -57.34 -36.14 70.8 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.973 0.909 . . . . 0.0 111.139 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -66.14 -21.98 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.179 0.592 . . . . 0.0 111.919 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.12 35.09 91.0 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -173.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -25.47 62.64 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.772 0.829 . . . . 0.0 111.394 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.83 -24.75 30.85 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.3 p -130.45 138.22 50.19 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.723 1.609 . . . . 0.0 107.546 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.0 mt -79.81 110.92 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.104 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -175.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -60.75 147.22 43.16 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.194 -0.316 . . . . 0.0 110.2 173.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.96 -48.07 1.54 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 175.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -59.42 -45.21 92.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.958 0.503 . . . . 0.0 111.29 178.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -62.22 -38.41 89.08 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.002 -0.436 . . . . 0.0 109.852 177.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.36 -40.09 93.14 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.653 -0.654 . . . . 0.0 110.91 175.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -58.45 -47.28 84.52 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.321 -0.862 . . . . 0.0 110.738 171.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.1 t -53.99 -49.11 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 118.433 0.561 . . . . 0.0 109.908 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.66 -56.0 18.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.023 0.529 . . . . 0.0 110.82 179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 18.0 mtm -53.45 -49.59 67.07 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.042 0.537 . . . . 0.0 111.264 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -57.97 -48.04 81.15 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.62 95.51 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.84 0.856 . . . . 0.0 111.247 178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.16 -30.76 69.54 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.579 0.752 . . . . 0.0 110.856 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.14 7.53 10.11 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.627 1.108 . . . . 0.0 112.854 171.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -72.14 167.31 20.54 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.29 1.045 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -105.31 87.16 1.91 Allowed Pre-proline 0 CA--C 1.538 0.506 0 C-N-CA 125.865 1.666 . . . . 0.0 108.706 176.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.87 73.92 2.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.543 2.162 . . . . 0.0 112.668 -172.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -64.0 115.25 4.73 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.541 0.737 . . . . 0.0 109.253 172.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -41.51 -47.96 3.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.606 1.562 . . . . 0.0 112.333 -174.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -52.09 -56.12 16.44 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.62 0.768 . . . . 0.0 110.639 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -66.07 -44.16 85.3 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.555 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 mm -54.41 -53.83 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.54 0.736 . . . . 0.0 110.4 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -54.8 -52.32 63.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 122.966 0.507 . . . . 0.0 110.414 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -55.24 -59.98 4.03 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 122.907 0.129 . . . . 0.0 110.693 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.3 ttp -53.89 -54.83 33.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.223 0.609 . . . . 0.0 110.568 -176.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.4 mt -55.45 -50.22 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.25 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 43.2 m -57.86 -44.16 86.41 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.359 0.982 . . . . 0.0 111.89 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.97 -47.32 81.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.67 0.214 . . . . 0.0 110.818 177.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 31.9 mm -74.75 -35.28 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 122.136 -0.352 . . . . 0.0 111.625 -177.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -80.03 46.41 0.8 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.308 1.443 . . . . 0.0 111.909 -169.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.69 -50.71 70.08 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.599 -0.688 . . . . 0.0 110.5 -173.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.44 -31.68 11.52 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.48 1.512 . . . . 0.0 110.128 177.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -52.8 -26.14 24.74 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.918 1.723 . . . . 0.0 115.34 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.3 m 50.09 58.7 5.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.051 0.94 . . . . 0.0 111.934 172.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.12 -24.27 27.62 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 124.559 1.076 . . . . 0.0 112.265 -177.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p -125.71 122.8 37.35 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.003 0.902 . . . . 0.0 112.022 -173.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 26.1 mm -75.32 106.45 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.82 158.72 34.95 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.324 0.583 . . . . 0.0 109.846 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -47.74 -40.12 19.63 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.013 0.925 . . . . 0.0 112.573 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -64.65 -47.26 79.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.449 1.022 . . . . 0.0 111.727 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.97 -48.12 80.9 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.521 -0.737 . . . . 0.0 110.136 174.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -55.71 -50.68 69.69 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.09 0.471 . . . . 0.0 110.632 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.2 tp -54.18 -49.1 70.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.864 1.665 . . . . 0.0 109.935 175.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.9 m -57.77 -51.31 70.07 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.893 -0.504 . . . . 0.0 110.527 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 59.8 ttp -55.31 -50.07 70.54 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.941 0.496 . . . . 0.0 109.869 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -46.72 81.36 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.19 0.596 . . . . 0.0 110.32 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.4 m -55.3 -52.07 64.66 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.925 0.49 . . . . 0.0 109.922 177.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.77 -42.48 89.04 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.456 0.303 . . . . 0.0 111.348 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -68.12 -40.31 82.53 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.641 0.776 . . . . 0.0 111.431 -178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 C--O 1.251 1.184 0 C-N-CA 124.961 1.304 . . . . 0.0 109.475 -177.362 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.391 0.139 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.9 m -72.77 65.71 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.462 1.105 . . . . 0.0 111.545 -177.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 157.15 -76.59 0.2 Allowed Glycine 0 CA--C 1.522 0.494 0 N-CA-C 107.317 -2.313 . . . . 0.0 107.317 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 77.4 mt -73.97 77.11 1.68 Allowed 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 170.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.7 p -65.72 166.11 11.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -53.96 -42.97 69.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 171.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -56.21 -49.13 74.96 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.915 0.486 . . . . 0.0 110.605 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 61.6 mm-40 -56.01 -48.97 74.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.704 0.684 . . . . 0.0 111.139 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -55.73 -44.18 77.3 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.287 0.494 . . . . 0.0 111.238 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -57.68 -52.87 63.67 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.777 0.831 . . . . 0.0 109.791 176.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -56.64 -47.06 80.57 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.983 -0.448 . . . . 0.0 111.314 178.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 84.6 mt -55.59 -46.28 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 123.307 0.643 . . . . 0.0 109.731 176.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -61.84 -46.45 89.4 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.765 -0.584 . . . . 0.0 111.16 178.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -55.57 -51.44 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.865 -0.522 . . . . 0.0 110.32 176.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.93 -50.88 67.75 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.978 0.511 . . . . 0.0 110.433 177.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -49.42 -62.58 1.47 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.126 0.571 . . . . 0.0 110.196 176.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -52.86 -46.2 67.74 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.472 0.709 . . . . 0.0 111.073 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 tt -56.68 -53.2 60.41 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.676 178.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -62.29 -37.8 86.89 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.267 0.485 . . . . 0.0 110.979 -179.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -70.91 29.27 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.6 2.36 . . . . 0.0 113.307 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 40.1 p -39.01 -62.06 0.68 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 127.168 2.187 . . . . 0.0 112.051 -176.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -98.74 -24.04 15.19 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.361 1.464 . . . . 0.0 110.317 177.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -51.82 -36.59 41.78 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.737 1.16 . . . . 0.0 111.689 177.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t 39.38 47.83 1.58 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.068 1.747 . . . . 0.0 113.288 169.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 138.99 -47.99 0.89 Allowed Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -173.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.0 p -136.45 123.65 21.77 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.418 0.687 . . . . 0.0 109.327 -173.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -72.08 123.9 27.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.83 147.47 41.12 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -36.41 -49.04 0.7 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.806 1.242 . . . . 0.0 112.8 171.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 mtpt -54.2 -54.86 34.07 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.059 0.944 . . . . 0.0 110.926 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -57.84 -41.66 82.81 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.077 0.551 . . . . 0.0 109.84 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 tp -63.78 -46.78 83.67 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.996 -0.44 . . . . 0.0 111.247 179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.257 19.9 ptpt -64.2 -36.11 82.99 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.221 -0.924 . . . . 0.0 111.556 177.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.96 -48.42 84.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.68 0.673 . . . . 0.0 110.105 171.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.2 -54.48 42.86 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 122.869 0.467 . . . . 0.0 110.493 177.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.8 mtm -53.88 -45.94 71.21 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.953 0.501 . . . . 0.0 111.43 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.24 -49.3 76.48 Favored 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 121.922 -0.486 . . . . 0.0 110.062 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.38 -40.12 77.48 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.784 0.434 . . . . 0.0 111.093 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.98 2.43 5.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.186 0.995 . . . . 0.0 113.027 174.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.59 18.76 65.34 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 119.185 0.902 . . . . 0.0 113.229 173.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -75.89 167.28 22.16 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.321 1.061 . . . . 0.0 110.092 172.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -109.52 105.85 57.74 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 169.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -56.86 71.67 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 124.887 3.724 . . . . 0.0 115.912 178.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -68.36 85.34 0.27 Allowed 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 169.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -31.17 -54.39 0.22 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 127.599 2.359 . . . . 0.0 113.629 -173.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -59.73 -48.73 80.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.814 0.446 . . . . 0.0 110.276 -177.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -64.6 -43.34 94.1 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.323 0.649 . . . . 0.0 109.68 179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 mm -54.04 -52.88 32.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 123.182 0.593 . . . . 0.0 109.904 176.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -57.94 -48.0 81.24 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.215 0.606 . . . . 0.0 110.812 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.31 -54.94 33.49 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 33.8 ttp -56.44 -52.61 64.02 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 123.352 0.661 . . . . 0.0 110.361 -179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 48.5 mt -48.39 -49.57 12.95 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.131 0 C-N-CA 123.116 0.566 . . . . 0.0 109.646 176.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.9 m -59.11 -49.38 78.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.753 -0.165 . . . . 0.0 111.397 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -56.63 -44.31 81.12 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.898 0.317 . . . . 0.0 111.368 178.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 46.0 mm -71.52 -34.96 54.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 122.692 0.397 . . . . 0.0 110.572 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -79.24 67.95 5.1 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.694 -0.629 . . . . 0.0 110.872 -174.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -49.16 -33.05 11.34 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.342 1.457 . . . . 0.0 113.705 176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -87.21 -17.91 31.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.547 0.612 . . . . 0.0 110.47 -177.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.16 9.51 86.75 Favored Glycine 0 N--CA 1.441 -1.02 0 C-N-CA 125.571 1.557 . . . . 0.0 114.367 171.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.2 t -79.56 39.56 0.41 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.316 1.558 . . . . 0.0 112.233 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 45.3 29.91 2.67 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 126.259 1.885 . . . . 0.0 114.657 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.0 p -157.03 161.95 39.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -173.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.6 mm -101.21 106.51 19.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -65.66 154.82 37.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.092 0.557 . . . . 0.0 109.857 169.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -43.73 -52.06 6.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.592 0.757 . . . . 0.0 112.857 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.43 -34.04 77.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.849 0.75 . . . . 0.0 111.297 -177.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -67.95 -42.43 80.96 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.467 -0.77 . . . . 0.0 109.408 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.16 -45.82 90.0 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.058 -0.401 . . . . 0.0 110.446 173.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tt -54.13 -47.8 71.49 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.354 1.062 . . . . 0.0 109.025 174.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.1 m -58.2 -49.41 77.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.934 0.494 . . . . 0.0 110.889 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 48.5 ttp -54.29 -52.71 60.59 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.86 -0.525 . . . . 0.0 110.171 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.97 -49.12 72.19 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.188 0.595 . . . . 0.0 110.044 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 66.1 m -53.71 -48.05 69.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.557 0.743 . . . . 0.0 110.745 176.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.64 -41.81 99.24 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.626 0.371 . . . . 0.0 111.478 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -68.6 -44.18 74.89 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 122.692 0.397 . . . . 0.0 111.53 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.976 -1.011 . . . . 0.0 111.053 178.903 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 . . . . . 0 N--CA 1.477 0.881 0 CA-C-O 120.396 0.141 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.7 p -146.38 155.6 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.5 -58.71 3.33 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 -174.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 92.7 mt -50.88 125.5 13.62 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.15 0.98 . . . . 0.0 110.276 170.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 65.8 p -65.41 160.56 21.72 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.786 0.434 . . . . 0.0 110.036 175.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.9 mp0 -52.81 -41.86 64.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.913 0.485 . . . . 0.0 109.889 172.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -54.68 -53.59 52.82 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.147 0.579 . . . . 0.0 110.578 175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -56.1 -45.63 79.38 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 122.04 -0.413 . . . . 0.0 110.851 175.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -55.8 -47.34 77.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.696 0.68 . . . . 0.0 111.112 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -56.19 -51.01 69.59 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.727 0.411 . . . . 0.0 110.277 176.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -53.7 -51.18 64.07 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 117.881 0.31 . . . . 0.0 110.776 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.22 -42.23 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 123.77 0.828 . . . . 0.0 110.242 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -58.98 -51.16 71.25 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.618 0.767 . . . . 0.0 110.167 175.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -64.15 -41.15 97.28 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.311 -0.868 . . . . 0.0 111.54 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.6 -51.76 66.06 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.016 -0.428 . . . . 0.0 110.162 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -50.66 -53.77 28.34 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.556 0.742 . . . . 0.0 110.754 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -52.68 -52.92 53.8 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.264 1.026 . . . . 0.0 110.242 179.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tt -55.84 -51.93 65.79 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.284 0.234 . . . . 0.0 110.854 178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -59.78 -39.41 84.8 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.419 -0.175 . . . . 0.0 110.545 -179.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.82 63.83 0.92 Allowed 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.471 0.709 . . . . 0.0 109.924 172.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 77.5 p -55.46 -26.59 43.15 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.822 0.849 . . . . 0.0 111.331 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.64 -18.92 64.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.249 1.02 . . . . 0.0 111.411 176.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.61 21.46 67.01 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 124.308 0.956 . . . . 0.0 113.254 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.0 p -86.41 -12.54 48.85 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 118.035 0.917 . . . . 0.0 112.774 -175.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.44 16.57 60.17 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.674 1.13 . . . . 0.0 110.52 -169.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -150.06 121.27 7.8 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.025 1.33 . . . . 0.0 108.45 -169.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 61.0 mt -81.56 114.66 22.84 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 176.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.16 148.33 50.23 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.906 0.775 . . . . 0.0 110.307 171.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.88 -47.99 1.1 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.053 0.941 . . . . 0.0 113.142 173.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -58.92 -46.52 87.72 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.148 0.579 . . . . 0.0 111.228 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -61.82 -41.18 97.47 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 tp -62.74 -45.25 93.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.599 0.636 . . . . 0.0 110.492 176.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -54.93 -50.18 69.48 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.702 -0.624 . . . . 0.0 110.233 175.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.8 t -56.33 -48.19 80.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 118.062 0.392 . . . . 0.0 110.542 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.72 -54.83 32.44 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.197 0.599 . . . . 0.0 110.458 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 71.6 mtm -56.03 -42.43 76.49 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.831 0.852 . . . . 0.0 110.992 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -60.56 -45.51 93.61 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.834 -0.541 . . . . 0.0 110.621 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.86 -37.99 84.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.533 0.733 . . . . 0.0 111.138 175.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.0 mt -68.22 -0.42 4.67 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.949 0.899 . . . . 0.0 112.121 171.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 86.5 13.94 66.82 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 124.786 1.184 . . . . 0.0 112.399 173.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -79.46 161.96 25.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.291 1.045 . . . . 0.0 109.825 -176.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -105.45 93.82 7.52 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 169.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -68.46 83.87 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.133 1.888 . . . . 0.0 112.353 -173.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -60.07 90.2 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.894 1.278 . . . . 0.0 110.041 170.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -31.37 -59.55 0.24 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 127.353 2.261 . . . . 0.0 114.051 -170.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.4 -47.68 83.1 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.641 0.655 . . . . 0.0 111.795 -176.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -65.8 -41.41 91.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.3 mm -56.69 -50.84 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 122.794 0.438 . . . . 0.0 110.285 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -60.08 -45.34 93.26 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 118.441 0.564 . . . . 0.0 111.155 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -53.93 -56.62 16.13 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.24 0.473 . . . . 0.0 110.282 175.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 45.9 ttp -54.42 -53.45 53.99 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.978 0.511 . . . . 0.0 110.81 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 45.5 mt -49.66 -49.54 19.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 123.512 0.725 . . . . 0.0 109.455 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -59.13 -46.22 88.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.342 0.519 . . . . 0.0 111.522 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.12 -42.95 86.9 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 122.648 0.379 . . . . 0.0 111.448 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.3 mm -74.79 -34.84 34.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 O-C-N 122.049 -0.407 . . . . 0.0 111.032 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -78.36 80.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.827 0.851 . . . . 0.0 110.63 -173.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.27 -44.33 15.06 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.556 0.742 . . . . 0.0 110.878 174.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -118.46 -24.29 6.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.851 1.26 . . . . 0.0 112.241 -175.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.37 -17.15 61.48 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 123.664 0.649 . . . . 0.0 114.611 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.0 t 52.7 58.15 5.65 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.588 1.194 . . . . 0.0 111.932 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.33 -23.03 37.4 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 123.995 0.807 . . . . 0.0 111.333 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.3 p -110.49 176.55 5.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.321 0.648 . . . . 0.0 109.543 175.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.1 mm -114.79 114.96 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.986 1.714 . . . . 0.0 106.93 169.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.49 160.08 32.1 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.552 1.141 . . . . 0.0 110.534 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -52.73 -52.07 57.82 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.842 0.457 . . . . 0.0 111.621 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -58.69 -44.72 90.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.322 0.51 . . . . 0.0 110.873 -179.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -56.93 -51.01 70.84 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.82 -48.37 78.14 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.165 0.586 . . . . 0.0 111.287 178.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -58.83 -45.42 90.04 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 121.804 -0.56 . . . . 0.0 110.0 178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.9 m -59.21 -52.24 66.53 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 122.083 -0.385 . . . . 0.0 110.292 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 21.2 ttt -49.21 -55.26 13.07 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.911 0.884 . . . . 0.0 109.982 175.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 44.0 tpp -54.85 -50.87 67.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 123.538 0.735 . . . . 0.0 110.211 -178.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 31.2 m -55.49 -46.32 76.94 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.091 0.557 . . . . 0.0 110.543 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.6 -42.04 95.82 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.996 0.518 . . . . 0.0 111.816 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -67.7 -45.99 73.54 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.002 0.521 . . . . 0.0 110.927 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 93.9 mtp . . . . . 0 C--O 1.25 1.101 0 CA-C-O 116.328 -1.796 . . . . 0.0 111.707 179.541 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 t 59.93 69.32 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 124.108 0.963 . . . . 0.0 109.607 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 77.8 -59.61 3.81 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.7 mt -71.19 87.46 0.8 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.567 0.747 . . . . 0.0 109.732 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.415 ' H ' ' NE2' ' A' ' 8' ' ' GLN . 41.6 p -63.37 164.73 8.63 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.87 0.468 . . . . 0.0 109.938 175.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -50.2 -46.91 54.83 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.942 0.497 . . . . 0.0 110.105 -178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -43.45 -56.29 3.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.165 1.386 . . . . 0.0 111.701 170.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.415 ' NE2' ' H ' ' A' ' 5' ' ' THR . 51.5 mt-30 -65.17 -39.75 93.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 121.962 -0.461 . . . . 0.0 110.158 -177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -60.76 -40.49 92.67 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.647 -0.658 . . . . 0.0 111.088 175.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -57.72 -51.52 69.19 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.787 -0.571 . . . . 0.0 109.838 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -53.19 -48.11 68.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.064 0.393 . . . . 0.0 111.208 177.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 87.0 mt -57.93 -46.15 87.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 123.769 0.828 . . . . 0.0 110.042 177.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -60.44 -46.24 90.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.712 0.687 . . . . 0.0 111.014 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -57.69 -52.1 66.83 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.778 0.431 . . . . 0.0 110.325 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.19 -50.21 69.94 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.746 0.418 . . . . 0.0 110.513 177.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -51.48 -54.9 22.35 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.541 0.736 . . . . 0.0 110.722 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -55.22 -49.34 72.22 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.759 0.824 . . . . 0.0 110.562 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 tt -56.06 -52.48 64.09 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 117.666 0.212 . . . . 0.0 110.656 178.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -60.13 -42.6 95.16 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.597 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -74.56 64.67 1.21 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.893 0.877 . . . . 0.0 109.735 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 72.1 p -56.58 -24.45 47.51 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.628 0.771 . . . . 0.0 111.923 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -72.65 -23.28 60.89 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.258 0.623 . . . . 0.0 111.083 176.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.84 -12.8 40.23 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.278 0.942 . . . . 0.0 114.044 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 m -82.63 44.66 0.91 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.839 1.819 . . . . 0.0 113.808 -169.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 51.55 26.48 15.86 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.548 1.547 . . . . 0.0 114.276 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.8 p -150.09 122.44 8.43 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.03 1.332 . . . . 0.0 109.086 -174.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -80.77 111.08 17.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 169.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -63.07 147.62 50.21 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.89 -46.81 1.35 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.507 1.123 . . . . 0.0 113.242 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.4 -48.14 82.76 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.959 0.504 . . . . 0.0 110.985 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -61.21 -41.52 97.0 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 tp -63.43 -44.19 95.3 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.939 -0.476 . . . . 0.0 110.299 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -56.42 -49.21 75.2 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.664 -0.648 . . . . 0.0 110.482 175.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 46.9 t -54.32 -49.09 66.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 174.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.51 -56.46 16.8 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.868 0.467 . . . . 0.0 110.735 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 48.5 mtm -56.05 -44.02 78.44 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.497 0.719 . . . . 0.0 111.487 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -58.11 -51.5 69.45 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.97 -41.43 78.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.342 0.657 . . . . 0.0 111.474 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -67.55 -10.89 56.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.456 1.103 . . . . 0.0 112.061 175.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.83 9.41 54.45 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 124.346 0.974 . . . . 0.0 113.242 172.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -74.15 165.35 25.31 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.7 1.25 . . . . 0.0 109.938 176.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -104.08 92.49 4.59 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.73 77.13 3.09 Favored 'Trans proline' 0 N--CA 1.452 -0.947 0 C-N-CA 121.786 1.657 . . . . 0.0 112.384 -170.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -60.74 97.42 0.06 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.45 1.1 . . . . 0.0 110.124 173.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -31.76 -51.99 0.23 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.691 2.397 . . . . 0.0 113.903 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -58.47 -56.26 24.48 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.089 0.555 . . . . 0.0 111.441 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -62.71 -42.64 99.75 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.2 mm -58.25 -49.28 82.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 C-N-CA 122.976 0.511 . . . . 0.0 110.638 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -57.63 -48.41 79.52 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.393 0.677 . . . . 0.0 109.911 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -53.73 -57.42 10.91 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -54.48 -54.01 46.63 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.435 1.094 . . . . 0.0 110.885 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 57.5 mt -50.28 -47.26 25.72 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.3 0.64 . . . . 0.0 109.896 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.0 m -62.15 -42.31 99.14 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.086 0.403 . . . . 0.0 111.604 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.35 -47.11 86.67 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.4 0.546 . . . . 0.0 111.153 175.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.64 -34.71 53.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 122.204 -0.31 . . . . 0.0 110.947 -177.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -85.55 92.34 8.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.804 0.841 . . . . 0.0 110.104 -176.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -54.6 -23.02 15.13 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.686 1.195 . . . . 0.0 112.979 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -92.69 -14.3 28.22 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.749 0.82 . . . . 0.0 110.342 -177.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 54.93 28.44 48.15 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.473 1.511 . . . . 0.0 114.047 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.0 p -90.34 -3.31 57.82 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.463 1.505 . . . . 0.0 112.274 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.86 38.35 19.98 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 110.807 -0.917 . . . . 0.0 110.807 -176.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 31.8 p -140.49 128.68 22.31 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.529 1.132 . . . . 0.0 109.496 -175.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 17.4 mm -95.24 108.76 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 171.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -70.67 159.48 34.36 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 173.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -51.28 -51.29 55.55 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 121.901 -0.499 . . . . 0.0 111.959 -178.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -53.72 -46.36 70.76 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.933 0.397 . . . . 0.0 111.029 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.48 -47.62 83.17 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.901 0.48 . . . . 0.0 109.864 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -54.97 -53.2 58.8 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.149 0.58 . . . . 0.0 110.47 176.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.3 tp -55.18 -47.02 75.79 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.278 0.631 . . . . 0.0 110.001 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.5 m -57.51 -49.73 75.36 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.229 -0.294 . . . . 0.0 110.564 177.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 53.8 ttp -55.19 -52.75 62.34 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.214 0.606 . . . . 0.0 110.302 178.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 93.6 mmm -53.61 -50.82 64.86 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.859 0.463 . . . . 0.0 110.134 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.8 m -54.97 -47.14 74.95 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.353 0.661 . . . . 0.0 110.785 178.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.07 -42.55 94.79 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.127 0.571 . . . . 0.0 111.001 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.35 -49.22 72.52 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 117.686 0.221 . . . . 0.0 110.925 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 25.2 ptt? . . . . . 0 C--O 1.249 1.067 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.785 -179.895 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.496 0.189 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.2 t -76.68 70.97 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 72.06 -68.69 1.08 Allowed Glycine 0 CA--C 1.527 0.842 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -172.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -74.55 135.48 42.12 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.184 0.593 . . . . 0.0 109.664 173.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.2 m -70.59 148.59 47.98 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 123.853 0.861 . . . . 0.0 108.876 174.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 mp0 -47.43 -43.99 24.38 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.364 0.665 . . . . 0.0 111.081 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -56.37 -42.94 78.65 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 122.033 -0.417 . . . . 0.0 111.656 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -63.81 -45.36 89.97 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -55.08 -48.37 73.63 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.093 0.406 . . . . 0.0 110.602 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -55.64 -53.02 61.7 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.945 0.898 . . . . 0.0 110.139 177.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -53.33 -47.6 69.2 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.923 0.489 . . . . 0.0 110.945 176.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.9 mt -61.13 -41.86 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 O-C-N 121.906 -0.496 . . . . 0.0 110.356 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -45.6 92.05 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.562 -0.711 . . . . 0.0 110.172 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -55.87 -52.75 62.98 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.359 -0.838 . . . . 0.0 110.44 176.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.65 -50.47 68.08 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.254 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -50.02 -55.7 13.68 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.322 0.649 . . . . 0.0 110.442 176.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -54.49 -51.52 64.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.363 0.665 . . . . 0.0 110.629 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.7 tt -57.2 -52.09 66.73 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-O 120.452 0.168 . . . . 0.0 110.938 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.01 -30.87 71.91 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.308 -0.245 . . . . 0.0 111.407 -178.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -76.31 47.18 0.45 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.833 1.253 . . . . 0.0 109.586 173.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.56 -43.47 89.35 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 125.646 1.579 . . . . 0.0 111.626 -169.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -119.63 -24.43 6.24 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.171 0.988 . . . . 0.0 111.436 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.35 -29.1 59.93 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 123.952 0.787 . . . . 0.0 112.967 -175.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.2 m 49.67 55.78 8.86 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.199 1.399 . . . . 0.0 112.53 169.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 145.19 -51.63 0.6 Allowed Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -177.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.9 p -141.96 135.39 29.32 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.44 0.696 . . . . 0.0 109.877 -172.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 81.2 mt -74.35 112.49 11.47 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.081 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -176.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.26 146.13 48.94 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.566 0.621 . . . . 0.0 109.952 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.17 -47.77 1.19 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.758 0.823 . . . . 0.0 112.803 172.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.61 -45.36 89.36 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.609 0.763 . . . . 0.0 111.376 177.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.1 -38.93 93.13 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.964 -0.46 . . . . 0.0 110.032 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.49 -40.23 92.83 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.725 -0.61 . . . . 0.0 110.502 176.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.7 tmmm? -57.29 -49.07 77.24 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.481 -0.762 . . . . 0.0 110.562 172.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.1 -50.03 47.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 118.62 0.646 . . . . 0.0 110.385 173.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.31 -55.11 27.34 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.525 0.73 . . . . 0.0 110.602 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 68.7 mtm -56.66 -41.4 77.16 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.337 0.655 . . . . 0.0 111.126 177.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.94 49.94 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 174.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.25 -40.2 81.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.556 0.742 . . . . 0.0 111.447 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 35.5 mt -68.16 -3.66 11.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.168 0.987 . . . . 0.0 112.312 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.58 24.25 56.62 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-N 119.372 0.987 . . . . 0.0 112.317 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.24 172.86 11.05 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -118.22 101.52 51.3 Favored Pre-proline 0 N--CA 1.454 -0.262 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -55.35 73.34 0.03 OUTLIER 'Trans proline' 0 CA--C 1.538 0.687 0 C-N-CA 124.578 3.518 . . . . 0.0 116.704 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -68.99 90.73 0.45 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 169.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -31.61 -49.08 0.16 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.327 2.251 . . . . 0.0 113.197 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.41 -58.66 6.34 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.807 0.843 . . . . 0.0 110.758 178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -67.16 -42.86 83.62 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.786 0.834 . . . . 0.0 109.696 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 12.3 mm -52.2 -56.11 7.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 123.568 0.747 . . . . 0.0 109.652 174.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.67 -51.36 69.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 123.342 0.657 . . . . 0.0 110.694 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -53.7 -57.19 11.74 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.806 0.275 . . . . 0.0 110.44 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.93 -53.71 52.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.581 0.752 . . . . 0.0 110.551 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 51.7 mt -50.32 -49.6 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 C-N-CA 122.826 0.45 . . . . 0.0 110.154 176.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -59.65 -47.28 86.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.031 0.378 . . . . 0.0 111.153 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -57.31 -44.73 84.39 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.6 0.36 . . . . 0.0 111.11 178.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 40.0 mm -71.33 -34.08 52.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 O-C-N 122.196 -0.315 . . . . 0.0 110.885 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -73.63 72.51 1.45 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.028 0.931 . . . . 0.0 110.679 -178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -59.81 -44.24 94.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.16 0.584 . . . . 0.0 111.066 173.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -142.12 -28.27 0.62 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.943 0.897 . . . . 0.0 113.2 -169.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.21 8.86 Favored Glycine 0 CA--C 1.541 1.674 0 N-CA-C 115.699 1.04 . . . . 0.0 115.699 -173.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.3 m 50.82 70.45 0.52 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.59 1.556 . . . . 0.0 112.912 169.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 90.37 -27.06 8.94 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 -178.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 21.3 p -105.43 163.64 12.48 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 117.306 0.553 . . . . 0.0 109.527 169.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.4 mm -120.37 115.31 46.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 C-N-CA 126.101 1.761 . . . . 0.0 106.709 178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -73.51 160.86 31.08 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 124.315 1.046 . . . . 0.0 110.512 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -49.31 -45.0 44.71 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 123.328 0.651 . . . . 0.0 111.97 176.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.5 -46.79 88.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.954 0.797 . . . . 0.0 110.927 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -61.64 -46.8 88.23 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.92 0.488 . . . . 0.0 109.733 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.06 -48.99 79.59 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.095 0.558 . . . . 0.0 110.637 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.31 -45.19 76.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.928 0.891 . . . . 0.0 109.918 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.0 m -57.26 -51.67 68.44 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.873 0.306 . . . . 0.0 110.274 175.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -53.56 -52.13 60.71 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.61 0.364 . . . . 0.0 110.711 177.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.7 mmm -60.61 -41.42 94.75 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.088 0.555 . . . . 0.0 111.014 -179.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 47.5 m -57.92 -45.02 87.19 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.555 -0.716 . . . . 0.0 109.481 173.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.65 59.85 1.2 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.847 0.859 . . . . 0.0 111.361 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.7 mttm 74.48 92.64 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.86 2.064 . . . . 0.0 112.182 176.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtm . . . . . 0 C--O 1.251 1.155 0 CA-C-O 117.077 -1.44 . . . . 0.0 111.564 174.359 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -67.26 -22.12 28.7 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 123.46 0.704 . . . . 0.0 112.579 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.98 -62.35 4.45 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 68.6 mt -114.15 99.39 7.59 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.251 1.42 . . . . 0.0 109.591 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 69.4 p -65.32 163.8 14.79 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.804 -0.56 . . . . 0.0 110.224 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -53.44 -34.92 59.7 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.078 0.551 . . . . 0.0 110.971 170.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -64.26 -51.47 63.4 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.226 -0.921 . . . . 0.0 109.857 176.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -55.3 -45.96 76.24 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.278 -0.264 . . . . 0.0 110.416 175.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -60.42 -39.61 88.04 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.519 -0.738 . . . . 0.0 111.746 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -58.82 -47.76 83.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.16 0.891 . . . . 0.0 111.025 171.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -57.3 -47.3 81.85 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.998 -0.439 . . . . 0.0 110.657 177.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 96.8 mt -60.51 -43.37 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.029 0.931 . . . . 0.0 109.926 178.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -56.8 -51.92 67.06 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.571 0.623 . . . . 0.0 110.323 172.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -53.85 -53.15 56.47 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 118.649 0.658 . . . . 0.0 110.876 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.38 -50.84 68.68 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.89 0.476 . . . . 0.0 110.654 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -52.64 -53.21 50.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.895 0.878 . . . . 0.0 110.331 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -56.0 -51.34 68.09 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.443 1.097 . . . . 0.0 110.526 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -57.38 -51.75 68.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.441 0.162 . . . . 0.0 110.661 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -60.18 -37.71 81.04 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.823 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -74.59 57.88 0.76 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.663 0.744 . . . . 0.0 109.156 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -28.44 68.94 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -178.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -80.23 9.15 6.04 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.332 1.053 . . . . 0.0 112.62 175.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 48.11 36.84 15.98 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.738 1.161 . . . . 0.0 113.437 173.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.3 m -95.57 3.83 53.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.442 1.097 . . . . 0.0 112.454 -171.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.77 14.7 58.75 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 124.008 0.813 . . . . 0.0 112.073 -174.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.3 p -154.46 134.84 13.34 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 105.808 -1.923 . . . . 0.0 105.808 -170.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 96.7 mt -85.99 105.66 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 105.745 -1.946 . . . . 0.0 105.745 169.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.22 149.35 41.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 174.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.07 -48.62 1.23 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.867 1.267 . . . . 0.0 112.881 174.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -57.86 -48.15 80.64 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.844 0.458 . . . . 0.0 111.033 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.77 -39.24 93.55 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.878 0.471 . . . . 0.0 110.128 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.4 tp -63.44 -41.91 98.66 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.818 -0.551 . . . . 0.0 109.869 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -59.37 -47.87 83.78 Favored 'General case' 0 CA--C 1.532 0.275 0 O-C-N 121.749 -0.594 . . . . 0.0 110.452 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.8 t -51.94 -52.02 25.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.489 0.586 . . . . 0.0 110.153 173.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.38 -53.12 55.68 Favored 'General case' 0 C--O 1.224 -0.245 0 C-N-CA 123.246 0.619 . . . . 0.0 110.765 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.43 -40.05 85.5 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.443 0.697 . . . . 0.0 111.54 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.26 -51.65 68.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 172.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.96 -38.11 75.42 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.848 -0.533 . . . . 0.0 111.841 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.3 mt -71.58 -1.58 14.03 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.419 1.088 . . . . 0.0 112.183 175.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 73.12 29.82 64.01 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 119.032 0.833 . . . . 0.0 112.009 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -81.55 169.73 16.73 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 117.586 0.693 . . . . 0.0 109.158 173.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 mp0 -110.54 103.42 54.19 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.808 1.243 . . . . 0.0 107.76 169.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -57.36 74.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.308 3.338 . . . . 0.0 115.874 177.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mptm? -66.15 85.26 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 169.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -31.45 -55.5 0.26 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.048 2.139 . . . . 0.0 114.031 -172.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.2 -49.1 79.13 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.883 -0.51 . . . . 0.0 111.368 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -62.86 -43.68 98.14 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.306 0.642 . . . . 0.0 109.505 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.2 mm -55.44 -53.47 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.46 0.704 . . . . 0.0 109.863 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -55.8 -50.93 69.15 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.556 0.342 . . . . 0.0 110.951 178.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -53.67 -55.5 25.47 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -54.39 -54.19 43.94 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 123.569 0.748 . . . . 0.0 110.732 -179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.8 mt -51.44 -47.29 35.75 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 177.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.7 m -59.6 -48.1 82.97 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.042 0.383 . . . . 0.0 111.298 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -56.26 -42.73 77.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.67 0.388 . . . . 0.0 111.178 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.8 mm -76.7 -35.17 24.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-N 118.068 0.395 . . . . 0.0 111.636 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -85.12 92.78 8.47 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.663 -0.648 . . . . 0.0 111.004 -171.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.66 -21.34 53.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.897 1.279 . . . . 0.0 113.571 177.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.17 1.16 30.38 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 119.067 0.849 . . . . 0.0 111.029 178.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 58.34 -4.38 0.08 OUTLIER Glycine 0 CA--C 1.535 1.289 0 C-N-CA 126.267 1.889 . . . . 0.0 116.554 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.8 m -85.89 49.41 1.77 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.912 1.856 . . . . 0.0 110.652 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 37.59 44.22 1.25 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 126.833 2.159 . . . . 0.0 114.45 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.2 p -142.33 136.06 29.29 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.062 0.931 . . . . 0.0 109.589 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.4 mm -102.16 112.38 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -71.5 158.11 36.83 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.32 0.648 . . . . 0.0 109.924 170.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.54 -48.65 48.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.559 0.743 . . . . 0.0 112.398 177.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.7 -42.83 89.51 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.25 -0.281 . . . . 0.0 110.266 -179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -64.82 -46.11 83.36 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.839 0.456 . . . . 0.0 110.118 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -54.86 -52.71 61.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.921 0.888 . . . . 0.0 110.291 176.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.16 -48.0 79.78 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 123.172 0.589 . . . . 0.0 110.028 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 87.9 m -57.64 -46.54 84.03 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.805 -0.559 . . . . 0.0 110.793 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 55.6 ttp -53.16 -42.98 66.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.672 0.789 . . . . 0.0 110.465 177.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 64.2 mtt -68.3 -53.35 24.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 177.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.6 m -49.07 -43.57 41.15 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.448 1.099 . . . . 0.0 111.346 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.38 -36.28 68.69 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.883 0.873 . . . . 0.0 111.956 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.2 mtmm -81.72 -40.91 22.03 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 86.4 mtp . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.665 -1.16 . . . . 0.0 109.995 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.244 0.545 . . . . 0.0 111.615 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.2 m -77.14 52.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 125.093 1.357 . . . . 0.0 112.87 -169.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -75.35 65.65 2.36 Favored Glycine 0 CA--C 1.528 0.851 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 176.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.3 mt -73.97 74.74 1.68 Allowed 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.212 -0.581 . . . . 0.0 110.921 -178.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 38.3 p -65.35 164.63 13.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 169.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.0 mp0 -55.62 -35.81 66.27 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.012 -0.43 . . . . 0.0 109.961 170.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -68.86 -45.09 71.95 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.537 -0.727 . . . . 0.0 109.969 -179.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.24 -49.74 71.23 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.336 0.516 . . . . 0.0 110.135 171.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -57.79 -47.36 82.78 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.908 -0.495 . . . . 0.0 110.898 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -53.04 -59.5 4.46 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.278 0.631 . . . . 0.0 110.445 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -48.13 -50.55 28.27 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.924 0.89 . . . . 0.0 111.098 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 94.5 mt -59.86 -45.06 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 122.745 0.418 . . . . 0.0 110.2 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -45.91 90.41 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.779 0.718 . . . . 0.0 110.908 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -49.68 76.77 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.545 -0.722 . . . . 0.0 110.469 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.05 -48.1 73.91 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.989 0.423 . . . . 0.0 110.23 176.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -53.33 -53.33 52.57 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.512 0.725 . . . . 0.0 110.651 176.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -54.54 -50.76 67.13 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.439 1.096 . . . . 0.0 110.078 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.26 -53.02 62.13 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -61.15 -37.05 81.49 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.065 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -74.41 60.66 0.87 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.41 0.684 . . . . 0.0 109.925 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 76.4 p -53.8 -34.16 58.29 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.202 1.001 . . . . 0.0 110.819 173.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -75.02 5.32 5.33 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.857 0.863 . . . . 0.0 112.836 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 48.19 34.21 12.15 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.784 1.183 . . . . 0.0 113.475 173.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.6 m -93.49 9.01 38.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.602 0.761 . . . . 0.0 112.434 -170.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.98 18.92 35.47 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.493 1.044 . . . . 0.0 111.926 -170.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.9 p -158.76 136.63 10.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.032 -1.84 . . . . 0.0 106.032 -169.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 88.4 mt -88.12 114.98 27.58 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.072 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 174.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -62.88 146.15 53.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.644 1.111 . . . . 0.0 109.777 173.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.95 -45.48 1.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.04 0.836 . . . . 0.0 113.022 173.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.46 -46.62 88.25 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.821 -0.549 . . . . 0.0 111.165 177.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -61.01 -38.59 86.63 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.934 -0.479 . . . . 0.0 110.13 176.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.7 tp -62.14 -43.2 99.35 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.809 -0.557 . . . . 0.0 110.277 174.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -58.54 -46.22 87.29 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.563 -0.71 . . . . 0.0 110.644 176.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.33 -45.86 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 O-C-N 122.051 -0.406 . . . . 0.0 110.498 173.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.14 -52.55 62.92 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.775 -0.578 . . . . 0.0 110.182 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 74.4 mtm -59.02 -42.2 89.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.54 0.736 . . . . 0.0 111.347 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -55.31 -49.76 71.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.866 -0.521 . . . . 0.0 110.335 172.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.8 -38.72 86.31 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.142 0.577 . . . . 0.0 111.34 178.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.9 mt -68.87 -2.47 9.7 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.292 1.037 . . . . 0.0 112.052 173.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 74.4 25.49 70.36 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 119.019 0.827 . . . . 0.0 111.978 177.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.67 165.55 21.9 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -107.11 106.95 59.69 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 169.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -58.87 73.66 0.05 OUTLIER 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 123.865 3.044 . . . . 0.0 115.096 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -67.96 96.3 0.59 Allowed 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.492 -0.755 . . . . 0.0 109.013 173.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -31.2 -60.31 0.21 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 127.543 2.337 . . . . 0.0 114.081 -172.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.4 tm-20 -58.02 -54.76 43.25 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -60.09 -41.76 93.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.695 0.798 . . . . 0.0 110.447 -178.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.8 mm -56.33 -55.61 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 123.135 0.574 . . . . 0.0 109.938 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -57.7 -46.02 84.91 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 122.379 -0.2 . . . . 0.0 110.84 -179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -55.19 -57.84 10.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 122.819 0.448 . . . . 0.0 109.903 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 43.4 ttp -54.41 -53.6 51.98 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.296 0.638 . . . . 0.0 110.233 -178.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.33 -50.29 28.16 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.0 m -58.59 -44.09 89.72 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.819 0.736 . . . . 0.0 111.913 179.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -59.52 -39.97 85.62 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 121.953 -0.467 . . . . 0.0 111.386 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -80.72 -34.56 14.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 118.136 0.425 . . . . 0.0 111.743 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -85.86 87.61 7.44 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.163 0.985 . . . . 0.0 110.903 -169.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -91.19 -47.73 7.35 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.889 0.876 . . . . 0.0 110.586 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -109.21 -28.93 8.75 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.672 1.189 . . . . 0.0 111.286 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -56.36 -27.16 52.76 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.287 0.946 . . . . 0.0 114.582 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.8 m 50.54 58.22 5.75 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.944 1.298 . . . . 0.0 112.301 171.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 98.66 -21.38 46.25 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 -177.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.6 p -108.03 -179.88 4.02 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 169.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.7 mm -122.14 119.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -74.96 158.83 32.63 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.087 0.955 . . . . 0.0 110.208 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -50.82 -47.57 60.04 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.614 0.366 . . . . 0.0 111.703 178.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.09 -45.29 87.44 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 121.128 0.49 . . . . 0.0 110.535 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -62.77 -46.49 87.76 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 122.976 0.51 . . . . 0.0 110.017 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -58.37 -48.71 79.72 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.94 0.496 . . . . 0.0 110.671 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.1 tp -55.61 -49.05 73.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.691 0.796 . . . . 0.0 109.743 175.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.9 m -55.98 -49.74 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 117.957 0.344 . . . . 0.0 110.499 178.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 57.4 ttp -54.32 -53.86 48.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.01 0.524 . . . . 0.0 110.498 177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 22.1 mmt -57.59 -47.95 80.71 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 110.523 -0.177 . . . . 0.0 110.523 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.1 m -53.59 -47.14 70.43 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.461 0.704 . . . . 0.0 110.345 177.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.61 -49.6 77.11 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 122.27 -0.269 . . . . 0.0 110.782 177.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -65.26 -51.67 59.31 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -175.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.6 mtm . . . . . 0 C--O 1.251 1.134 0 CA-C-O 117.322 -1.323 . . . . 0.0 111.939 -169.875 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 50.6 ptt85 . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 119.891 -0.1 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 t 67.88 -67.26 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.818 1.647 . . . . 0.0 111.064 179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.7 45.98 94.79 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 123.514 0.578 . . . . 0.0 112.162 175.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 96.6 mt -121.29 89.47 3.13 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.969 1.308 . . . . 0.0 108.587 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.1 p -65.49 160.29 22.55 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 121.961 -0.462 . . . . 0.0 110.09 173.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -54.44 -42.12 70.22 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 172.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -52.67 -55.3 23.54 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.797 0.839 . . . . 0.0 109.858 175.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -53.86 -50.49 66.15 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 119.117 -0.468 . . . . 0.0 110.843 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.86 -47.61 73.98 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.738 0.699 . . . . 0.0 111.268 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -57.95 -50.32 73.76 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.008 0.523 . . . . 0.0 110.855 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -58.5 -47.28 84.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.111 0.414 . . . . 0.0 111.118 178.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.77 -41.59 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -62.41 -47.48 83.92 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.64 -0.663 . . . . 0.0 110.948 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -53.97 -53.47 52.35 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.91 -49.25 69.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 122.99 0.516 . . . . 0.0 110.466 177.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -52.49 -57.64 9.27 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.354 0.662 . . . . 0.0 110.994 178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -56.86 -47.53 80.2 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 122.943 0.497 . . . . 0.0 110.402 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.8 tt -54.92 -53.74 51.61 Favored 'General case' 0 C--N 1.338 0.074 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 177.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -60.01 -37.78 80.75 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 119.261 -0.4 . . . . 0.0 111.172 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -73.75 61.88 0.78 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.703 0.683 . . . . 0.0 109.601 169.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 57.0 p -53.61 -37.95 63.53 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.664 1.186 . . . . 0.0 111.158 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.15 -22.44 66.37 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.78 0.432 . . . . 0.0 112.079 178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.81 34.97 84.17 Favored Glycine 0 CA--C 1.527 0.833 0 N-CA-C 111.364 -0.694 . . . . 0.0 111.364 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.7 m -67.47 -25.49 65.9 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.588 0.694 . . . . 0.0 111.878 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.73 -27.99 12.27 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 125.303 1.43 . . . . 0.0 109.74 -169.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.0 p -130.76 147.04 52.37 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.914 2.086 . . . . 0.0 108.26 -178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.92 119.95 27.72 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.107 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -64.46 144.6 57.06 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 119.581 1.082 . . . . 0.0 110.1 173.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -38.03 -48.79 1.23 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -62.5 -43.51 98.65 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.722 -0.611 . . . . 0.0 110.945 179.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -60.17 -40.32 89.5 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.944 -0.473 . . . . 0.0 109.979 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -63.06 -43.91 97.29 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.786 -0.571 . . . . 0.0 110.223 175.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -57.48 -48.51 79.02 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.479 -0.763 . . . . 0.0 110.744 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 42.6 t -53.68 -50.58 50.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.781 0.433 . . . . 0.0 110.327 172.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.58 -53.19 49.88 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.117 0.567 . . . . 0.0 110.543 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 69.7 mtm -60.18 -42.71 95.58 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.356 0.662 . . . . 0.0 111.188 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -58.38 6.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.14 82.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.908 0.883 . . . . 0.0 112.19 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.6 mt -62.94 -16.5 59.47 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.723 1.209 . . . . 0.0 111.76 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.32 24.47 12.49 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 118.637 0.653 . . . . 0.0 112.334 175.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -80.57 176.79 9.48 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 169.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -115.39 97.81 49.25 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.571 -1.64 . . . . 0.0 106.571 169.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -60.98 66.77 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.249 3.299 . . . . 0.0 116.684 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -65.64 104.99 1.13 Allowed 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.35 -0.844 . . . . 0.0 109.071 171.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -42.49 -46.83 4.94 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.525 1.53 . . . . 0.0 114.139 -170.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -59.72 -57.56 12.41 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.29 0.496 . . . . 0.0 110.37 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -58.32 -44.97 88.89 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.712 0.805 . . . . 0.0 109.929 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.1 mm -53.43 -57.83 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.569 0.747 . . . . 0.0 110.18 175.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -57.72 -47.3 82.79 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 118.067 0.394 . . . . 0.0 111.097 -178.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -55.12 -58.2 8.65 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 52.7 ttp -56.1 -52.24 65.03 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 122.842 0.457 . . . . 0.0 110.567 -178.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 39.3 mt -49.79 -51.18 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.253 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.1 m -57.53 -49.72 75.42 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.173 0.442 . . . . 0.0 111.477 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -56.88 -43.53 81.37 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 117.838 0.29 . . . . 0.0 111.467 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 32.2 mm -71.59 -34.78 53.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 122.01 -0.431 . . . . 0.0 110.673 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -78.9 71.4 5.36 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.481 0.713 . . . . 0.0 111.682 -169.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -65.91 -46.77 77.1 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.303 0.641 . . . . 0.0 111.845 176.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -119.54 -40.06 2.82 Favored 'General case' 0 C--N 1.338 0.093 0 C-N-CA 125.423 1.489 . . . . 0.0 111.625 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -55.44 -20.07 21.38 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.468 1.033 . . . . 0.0 115.609 -169.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 m 48.13 63.64 1.97 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.247 1.419 . . . . 0.0 112.623 170.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 98.85 -30.3 10.03 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.889 -0.885 . . . . 0.0 110.889 -177.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.8 p -102.78 175.94 5.32 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 169.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.9 mm -128.33 118.44 47.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 175.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -77.36 170.01 17.3 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-O 121.5 0.667 . . . . 0.0 111.221 177.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.44 -36.25 73.37 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.624 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -69.43 -50.17 48.25 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.439 0.563 . . . . 0.0 109.706 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -54.11 -50.2 67.43 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.914 0.886 . . . . 0.0 109.92 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -56.53 -54.85 41.09 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 122.958 0.503 . . . . 0.0 110.747 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -53.08 -47.24 68.69 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.601 0.76 . . . . 0.0 110.128 178.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 m -56.23 -52.05 65.87 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.619 0.368 . . . . 0.0 110.343 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 47.5 ttp -55.2 -56.82 15.64 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 96.0 mmm -54.25 -45.18 72.32 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.869 0.468 . . . . 0.0 110.28 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 56.3 m -56.58 -52.52 64.52 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 174.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.21 -34.69 68.79 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.04 0.536 . . . . 0.0 112.131 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -64.22 -22.09 66.82 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.726 -0.654 . . . . 0.0 112.39 176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-N 119.221 0.919 . . . . 0.0 110.976 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 . . . . . 0 N--CA 1.473 0.715 0 CA-C-O 120.479 0.18 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.8 m -74.04 45.69 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.966 1.306 . . . . 0.0 111.581 176.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.44 -68.94 0.25 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 124.218 0.913 . . . . 0.0 111.854 -173.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 72.9 mt -74.27 141.82 45.3 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.348 1.059 . . . . 0.0 111.978 -173.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.5 p -69.19 162.76 26.41 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.757 0.823 . . . . 0.0 110.015 169.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -57.55 -41.49 81.07 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 121.688 -0.632 . . . . 0.0 109.666 169.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.6 mp0 -55.18 -52.87 61.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.518 0.727 . . . . 0.0 109.973 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -55.41 -51.1 67.98 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.921 -0.487 . . . . 0.0 111.141 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 37.7 mtmm -59.33 -41.93 90.25 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.711 0.687 . . . . 0.0 111.646 -178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -57.89 -53.63 56.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.114 1.366 . . . . 0.0 110.072 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -53.75 -48.7 69.44 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.234 0.614 . . . . 0.0 110.59 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 92.4 mt -60.35 -42.07 89.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 122.828 0.451 . . . . 0.0 110.276 179.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -61.35 -45.63 93.58 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.593 0.633 . . . . 0.0 110.851 175.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -58.04 -50.72 72.45 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.47 0.577 . . . . 0.0 110.672 177.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.55 -52.54 61.75 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -48.08 -60.15 2.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.532 0.733 . . . . 0.0 109.877 175.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -51.31 -49.18 61.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.321 1.048 . . . . 0.0 110.825 -177.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tt -56.86 -52.64 64.34 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.703 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -61.51 -36.37 80.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.172 0.442 . . . . 0.0 111.506 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -72.74 31.68 0.06 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.313 2.245 . . . . 0.0 113.071 -173.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 37.2 p -42.81 -59.42 1.97 Allowed 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 127.512 2.325 . . . . 0.0 111.796 -173.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -98.14 -25.59 14.86 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.84 1.256 . . . . 0.0 110.002 175.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -54.81 -31.42 54.32 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.988 1.28 . . . . 0.0 113.384 -174.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m 38.17 55.85 1.71 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.518 1.527 . . . . 0.0 114.055 169.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 124.77 -41.99 1.61 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 124.696 1.141 . . . . 0.0 110.825 -174.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 p -135.69 120.96 19.04 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 117.788 0.794 . . . . 0.0 110.239 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.7 mt -72.89 114.12 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.07 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -63.18 147.38 51.07 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.203 0.456 . . . . 0.0 110.216 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -37.47 -47.85 0.92 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.053 0.941 . . . . 0.0 113.178 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -58.36 -49.26 77.84 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.927 0.491 . . . . 0.0 111.168 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -59.08 -42.75 91.18 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.29 -42.34 99.27 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.966 -0.458 . . . . 0.0 110.902 177.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -60.02 -47.91 83.9 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.335 -0.853 . . . . 0.0 110.445 176.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.4 t -54.62 -48.62 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 173.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -53.27 55.14 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.862 0.465 . . . . 0.0 110.584 177.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 57.3 mtm -57.95 -42.65 85.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.271 0.628 . . . . 0.0 111.599 179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -56.57 -52.07 66.2 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.512 0.596 . . . . 0.0 110.116 173.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.49 75.57 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 122.093 -0.38 . . . . 0.0 111.64 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 33.0 mt -72.28 -2.49 19.23 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.863 1.265 . . . . 0.0 112.355 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 82.49 20.94 61.07 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 119.235 0.925 . . . . 0.0 113.362 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -83.36 159.68 21.8 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 118.259 1.029 . . . . 0.0 109.763 171.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -104.43 98.75 15.2 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 169.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.36 80.47 1.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 122.357 2.038 . . . . 0.0 112.15 -173.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -59.79 90.54 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.213 1.405 . . . . 0.0 109.518 170.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -32.39 -51.7 0.27 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.058 2.143 . . . . 0.0 115.207 -171.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -60.15 -51.31 70.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.822 0.737 . . . . 0.0 110.535 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -62.79 -41.11 99.13 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.0 mm -59.16 -47.86 88.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 122.936 0.494 . . . . 0.0 110.562 175.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -58.67 -48.17 81.99 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.852 0.751 . . . . 0.0 110.453 177.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -54.7 -58.06 9.01 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -48.35 -59.61 3.32 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 125.421 1.488 . . . . 0.0 110.713 178.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.7 mt -51.38 -49.27 32.2 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.277 0 C-N-CA 123.472 0.709 . . . . 0.0 109.907 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.2 m -60.06 -47.1 87.28 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.582 0.628 . . . . 0.0 111.592 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.8 -45.49 85.99 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.483 0.313 . . . . 0.0 110.885 178.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 44.0 mm -71.65 -35.6 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 122.098 -0.376 . . . . 0.0 111.168 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -82.2 75.25 9.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.54 -0.725 . . . . 0.0 110.507 -170.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -58.22 -15.33 9.56 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.154 0.981 . . . . 0.0 113.11 172.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -91.08 -13.9 32.27 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.773 1.229 . . . . 0.0 110.214 178.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 52.48 35.99 45.88 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 126.259 1.885 . . . . 0.0 114.219 175.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.6 p -100.53 -7.82 23.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.814 1.246 . . . . 0.0 112.499 -177.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 79.21 21.25 67.95 Favored Glycine 0 CA--C 1.532 1.133 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -169.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p -136.1 150.01 48.94 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.93 0.892 . . . . 0.0 108.931 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 28.3 mm -109.11 110.24 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 125.006 1.322 . . . . 0.0 108.102 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.21 152.09 45.58 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 171.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.7 -44.77 13.81 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -59.5 -46.8 87.8 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.489 0.586 . . . . 0.0 110.921 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -62.84 -45.95 90.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.019 0.528 . . . . 0.0 109.731 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -56.48 -50.81 70.65 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 123.7 0.8 . . . . 0.0 110.628 176.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.98 -46.91 84.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.723 0.809 . . . . 0.0 109.709 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.1 m -56.54 -53.7 54.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 117.832 0.287 . . . . 0.0 110.346 177.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -51.33 -53.96 31.0 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.095 0.958 . . . . 0.0 110.053 177.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 12.7 tpt -61.29 -44.11 97.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.024 0.53 . . . . 0.0 110.411 -176.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.0 m -56.65 -50.72 71.24 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 175.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.42 91.28 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.753 0.421 . . . . 0.0 111.368 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.68 -45.34 94.4 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.641 0.776 . . . . 0.0 110.548 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 89.6 mmm . . . . . 0 C--O 1.251 1.133 0 CA-C-O 117.194 -1.384 . . . . 0.0 109.914 179.82 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -75.63 166.01 2.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 70.37 -166.29 50.97 Favored Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -177.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.2 mt -77.04 95.58 4.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.997 0.427 . . . . 0.0 111.045 -176.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.6 p -65.51 161.03 20.96 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.318 0.647 . . . . 0.0 109.389 169.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -56.06 -37.82 69.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.418 -0.801 . . . . 0.0 110.654 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -56.41 -53.66 54.82 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.169 0.588 . . . . 0.0 110.415 174.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -55.65 -44.87 77.59 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 175.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -53.59 -43.72 68.82 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.875 0.47 . . . . 0.0 111.243 176.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -58.26 -53.23 60.61 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 175.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -55.26 -44.35 75.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.543 0.211 . . . . 0.0 111.22 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.47 -45.31 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.016 0.926 . . . . 0.0 109.8 178.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.6 tpp180 -57.45 -52.47 65.24 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.283 0.492 . . . . 0.0 110.604 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -54.45 -50.84 66.75 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.483 -0.761 . . . . 0.0 111.221 178.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.8 72.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.195 0.598 . . . . 0.0 110.559 177.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -52.41 -53.68 41.97 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.704 0.801 . . . . 0.0 110.311 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 -56.49 -50.65 71.16 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.254 0.621 . . . . 0.0 110.211 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.1 tt -57.18 -52.23 66.16 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -60.45 -39.07 86.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.113 0.165 . . . . 0.0 110.595 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -74.25 58.14 0.7 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.91 -31.93 71.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.343 1.057 . . . . 0.0 110.684 -173.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -67.97 -22.39 65.03 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 112.383 175.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.26 36.13 51.25 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.8 m -77.94 1.66 19.94 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.453 1.101 . . . . 0.0 113.136 177.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.95 11.01 42.43 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.538 1.542 . . . . 0.0 112.427 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.1 p -158.18 143.65 16.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 -169.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.7 mt -87.89 110.81 21.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 178.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -61.07 147.28 44.33 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.459 1.027 . . . . 0.0 110.324 175.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -39.43 -48.54 1.96 Allowed 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.907 0.776 . . . . 0.0 113.037 173.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -59.3 -45.93 89.94 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.836 0.454 . . . . 0.0 110.996 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.22 -36.59 82.44 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.992 -0.442 . . . . 0.0 110.517 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tp -65.89 -41.89 90.97 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.651 -0.655 . . . . 0.0 110.069 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -57.89 -49.45 76.67 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.738 -0.601 . . . . 0.0 110.294 173.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 38.5 t -51.98 -51.37 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 118.066 0.394 . . . . 0.0 110.16 173.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -55.9 21.97 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.721 0.808 . . . . 0.0 110.743 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 59.6 mtm -54.84 -45.72 74.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.36 0.664 . . . . 0.0 110.99 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.0 tpt85 -58.22 -48.01 81.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.756 -0.59 . . . . 0.0 110.444 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.16 79.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.978 0.511 . . . . 0.0 111.35 176.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -70.1 -0.47 7.77 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.532 1.133 . . . . 0.0 112.222 174.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.81 16.76 62.87 Favored Glycine 0 CA--C 1.528 0.857 0 CA-C-N 119.117 0.872 . . . . 0.0 112.771 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -75.93 162.05 28.43 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.267 1.033 . . . . 0.0 109.436 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -108.19 105.77 57.21 Favored Pre-proline 0 N--CA 1.449 -0.506 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -56.13 78.5 0.03 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.312 3.341 . . . . 0.0 115.253 -178.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -66.35 81.37 0.09 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.161 0.984 . . . . 0.0 108.933 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -31.72 -56.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 127.329 2.252 . . . . 0.0 113.926 -171.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -54.98 -50.89 67.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.971 0.415 . . . . 0.0 110.942 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.65 -40.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.07 0.548 . . . . 0.0 109.692 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.1 mm -53.64 -54.78 16.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 172.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -56.09 -52.67 63.46 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.673 0.789 . . . . 0.0 109.775 -179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -52.44 -57.86 8.54 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.897 0.479 . . . . 0.0 110.308 177.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.3 tmm? -51.76 -54.46 28.34 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.8 0.84 . . . . 0.0 110.582 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.4 mt -51.61 -49.67 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -57.06 -48.1 79.37 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.056 0.389 . . . . 0.0 111.419 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -58.96 -42.35 89.68 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.94 0.337 . . . . 0.0 111.094 178.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.6 mm -71.06 -31.32 44.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 O-C-N 122.156 -0.34 . . . . 0.0 111.231 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.37 75.74 0.54 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.855 0.862 . . . . 0.0 111.635 -173.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -81.96 -35.92 28.49 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.907 1.683 . . . . 0.0 109.848 171.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -152.54 31.18 0.52 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.66 1.584 . . . . 0.0 109.316 -172.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.5 -37.64 3.46 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.205 0.907 . . . . 0.0 111.757 -170.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.6 p 45.08 56.75 5.2 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.857 1.263 . . . . 0.0 111.49 -176.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.26 -10.63 68.17 Favored Glycine 0 CA--C 1.533 1.194 0 CA-C-O 119.462 -0.632 . . . . 0.0 113.252 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 p -113.99 171.8 7.38 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.138 0.969 . . . . 0.0 108.815 169.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.6 mm -112.05 116.22 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 169.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -70.96 156.54 39.49 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.429 0.692 . . . . 0.0 109.783 174.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -51.99 -43.45 63.62 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.904 -0.497 . . . . 0.0 111.728 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -57.45 -46.38 83.68 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.354 0.524 . . . . 0.0 110.66 178.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.15 -47.42 82.8 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.753 0.421 . . . . 0.0 110.113 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -57.02 -51.71 68.16 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.691 0.758 . . . . 0.0 110.304 178.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.2 tp -52.87 -46.27 67.8 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.957 0.903 . . . . 0.0 110.044 174.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 59.2 m -58.3 -47.85 82.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.319 0.509 . . . . 0.0 111.192 177.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 77.5 mtp -53.26 -51.29 62.71 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.695 0.679 . . . . 0.0 109.827 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.59 -41.28 94.38 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.862 -179.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.8 m -60.93 -44.63 96.94 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.223 0.609 . . . . 0.0 109.981 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.19 93.18 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 122.512 0.325 . . . . 0.0 110.519 177.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.77 -42.34 90.98 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 176.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 67.3 mtm . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.266 -1.349 . . . . 0.0 110.705 -178.155 . . . . . . . . 0 0 . 1 stop_ save_