data_2l6j_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 2l6j _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 ' 3' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -10.92 60.09 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -88.83 -36.7 15.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.115 1.366 . . . . 0.0 111.92 172.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -80.19 -24.28 40.41 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.42 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.5 -30.2 62.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.371 0.987 . . . . 0.0 112.791 175.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -73.38 -33.03 64.82 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.952 -1.093 . . . . 0.0 112.971 171.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.15 -36.72 83.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.505 0.722 . . . . 0.0 112.614 169.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.48 -44.54 93.03 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.376 -0.827 . . . . 0.0 110.544 168.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.11 -50.53 58.83 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.556 0.598 . . . . 0.0 113.384 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -61.49 -40.71 95.54 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 118.432 1.116 . . . . 0.0 112.011 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -64.14 -36.94 85.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.388 1.075 . . . . 0.0 112.383 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.5 mt -69.8 -39.02 76.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.341 1.057 . . . . 0.0 112.114 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -61.49 -28.51 69.35 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 118.932 0.787 . . . . 0.0 112.533 167.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.8 -7.34 54.2 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -110.98 -31.32 7.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.953 1.301 . . . . 0.0 112.859 172.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.8 9.15 14.48 Favored Glycine 0 N--CA 1.476 1.31 0 C-N-CA 124.216 0.912 . . . . 0.0 114.474 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.84 54.87 3.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.994 1.717 . . . . 0.0 110.293 176.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -57.23 -34.51 68.65 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.008 0.923 . . . . 0.0 113.26 -171.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.23 -32.76 56.06 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.311 1.414 . . . . 0.0 111.845 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.92 -32.97 65.68 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 118.668 0.667 . . . . 0.0 111.969 168.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.45 -41.03 85.37 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.905 -1.122 . . . . 0.0 112.298 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.4 t -62.02 -39.74 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.545 1.138 . . . . 0.0 110.89 168.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -56.91 -32.47 65.96 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.314 0.961 . . . . 0.0 112.369 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.7 m -71.71 -39.74 69.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.259 -0.877 . . . . 0.0 113.295 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -38.71 75.05 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.301 1.409 . . . . 0.0 111.081 172.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -61.13 -32.17 71.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.107 1.363 . . . . 0.0 111.855 177.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -60.99 -40.08 92.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.671 1.123 . . . . 0.0 112.072 171.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.22 -42.8 88.2 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.774 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.1 mt -76.18 -22.52 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.123 0.969 . . . . 0.0 111.188 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 55.6 m -67.96 -41.92 81.68 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.891 -1.756 . . . . 0.0 111.222 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.32 -20.9 26.13 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.83 65.22 37.76 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.655 1.582 . . . . 0.0 110.809 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -61.93 -22.95 75.31 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.581 2.854 . . . . 0.0 117.27 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -123.33 10.68 9.28 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.42 1.488 . . . . 0.0 111.27 -170.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -90.64 131.77 36.94 Favored Pre-proline 0 CA--C 1.544 0.737 0 O-C-N 120.574 -1.329 . . . . 0.0 111.292 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.75 -17.46 60.01 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.683 2.255 . . . . 0.0 114.065 177.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.7 p -53.55 -42.67 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 119.028 0.831 . . . . 0.0 111.926 170.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.55 -37.97 85.81 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.18 -0.95 . . . . 0.0 111.624 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -69.84 -35.24 74.6 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.556 0.742 . . . . 0.0 112.64 175.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.6 t -61.26 -36.77 80.92 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.073 -1.017 . . . . 0.0 112.469 170.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -77.97 -28.49 49.43 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.513 0.725 . . . . 0.0 112.57 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -68.17 -41.94 80.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.873 1.215 . . . . 0.0 111.65 166.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.07 81.44 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.119 -0.988 . . . . 0.0 112.404 173.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -61.53 -49.41 76.82 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.269 1.028 . . . . 0.0 111.457 169.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.57 82.35 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.258 0.623 . . . . 0.0 112.221 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.3 mt -62.08 -42.85 99.63 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.894 0.878 . . . . 0.0 112.598 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.14 -20.73 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 119.55 1.068 . . . . 0.0 113.123 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.24 -8.27 56.99 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.604 1.162 . . . . 0.0 114.061 172.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.4 7.79 21.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.68 1.992 . . . . 0.0 112.735 170.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.16 17.98 79.65 Favored Glycine 0 CA--C 1.535 1.343 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 174.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -104.28 52.83 0.75 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.848 1.659 . . . . 0.0 110.75 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.64 -29.89 64.94 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.101 1.36 . . . . 0.0 112.683 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 m -62.99 -27.67 69.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.679 0.792 . . . . 0.0 112.506 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -77.02 -40.86 44.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.176 0.898 . . . . 0.0 111.299 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.09 93.22 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.385 -0.822 . . . . 0.0 113.005 -175.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.7 pt -63.88 -30.66 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -78.24 -45.56 22.61 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.6 171.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.9 ttm -65.13 -28.87 69.72 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.162 -0.961 . . . . 0.0 113.083 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.9 m -66.42 -39.93 89.25 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.99 -1.069 . . . . 0.0 112.295 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -62.71 -45.73 91.37 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.036 0.835 . . . . 0.0 110.391 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.99 -37.06 68.61 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.87 -23.65 59.32 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.224 1.375 . . . . 0.0 115.066 177.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.74 -18.93 65.68 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.57 1.685 . . . . 0.0 112.416 171.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -72.14 5.01 3.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.443 1.497 . . . . 0.0 114.829 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -121.35 44.18 2.61 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.475 1.91 . . . . 0.0 111.037 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.0 p -132.13 -2.19 3.6 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -164.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 81.6 p -63.93 -15.85 60.1 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 -164.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 p -120.17 165.97 14.06 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 120.586 1.539 . . . . 0.0 113.7 -173.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.82 -0.86 1.64 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.1 1.36 . . . . 0.0 114.594 174.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -83.32 -17.63 41.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.344 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -129.98 15.09 5.78 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.492 1.517 . . . . 0.0 114.203 -166.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.54 -30.34 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 120.494 -1.379 . . . . 0.0 112.32 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.55 -38.81 81.11 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.176 -0.953 . . . . 0.0 112.086 171.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.2 mm -61.56 -37.93 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.593 1.157 . . . . 0.0 110.687 174.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.09 -44.37 96.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.607 1.163 . . . . 0.0 112.619 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 t -63.78 -48.54 76.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 111.892 167.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.3 ttpt -58.0 -44.43 87.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 112.939 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.05 -24.47 51.98 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.779 1.172 . . . . 0.0 113.794 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.96 -34.2 59.81 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.278 1.399 . . . . 0.0 113.459 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -35.37 58.59 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.116 0.871 . . . . 0.0 111.647 168.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -57.76 -40.58 80.1 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.039 1.29 . . . . 0.0 111.659 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -65.69 -41.76 92.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.933 0.893 . . . . 0.0 112.874 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.817 0.847 . . . . 0.0 111.017 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.21 -20.03 35.37 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.77 -50.88 65.07 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.925 1.239 . . . . 0.0 110.329 164.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.86 -28.25 69.36 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.927 0.891 . . . . 0.0 111.964 171.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.24 -55.68 17.47 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 127.535 2.493 . . . . 0.0 112.591 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.69 76.52 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.986 1.714 . . . . 0.0 112.56 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.3 p . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 175.163 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.61 -30.88 66.29 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.103 -0.998 . . . . 0.0 112.527 177.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.45 -28.12 64.77 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.034 1.734 . . . . 0.0 112.48 165.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.34 -45.61 17.49 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.742 0.817 . . . . 0.0 112.9 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -66.28 -27.17 67.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.882 1.219 . . . . 0.0 112.858 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -64.01 -45.93 86.75 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.604 1.093 . . . . 0.0 111.571 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.77 -34.78 60.27 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 -39.8 71.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.958 1.254 . . . . 0.0 111.649 175.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.97 -35.26 91.77 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 120.925 -1.109 . . . . 0.0 112.714 170.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -62.23 -40.46 96.21 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.127 -1.219 . . . . 0.0 112.111 169.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.3 t -63.23 -35.85 81.69 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.513 -0.742 . . . . 0.0 112.151 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.4 mt -65.98 -36.93 84.65 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.606 -1.308 . . . . 0.0 112.482 172.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.73 -33.56 76.15 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.651 1.114 . . . . 0.0 112.228 167.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.9 -2.28 17.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.573 1.549 . . . . 0.0 114.598 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -113.28 -50.74 2.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.495 1.918 . . . . 0.0 112.35 175.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.3 0.23 3.41 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.863 1.22 . . . . 0.0 115.34 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -85.33 51.99 2.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.749 2.42 . . . . 0.0 111.319 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.88 -33.57 70.64 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.987 1.315 . . . . 0.0 113.15 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -68.7 -47.11 67.22 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.927 1.24 . . . . 0.0 110.351 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.41 -36.58 79.31 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.325 0.39 . . . . 0.0 111.41 176.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.16 77.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.318 0.647 . . . . 0.0 112.62 176.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.2 t -62.43 -37.28 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.674 0.79 . . . . 0.0 110.77 174.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -61.02 -39.2 88.85 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.037 0.835 . . . . 0.0 112.651 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -66.04 -40.96 91.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.44 0.696 . . . . 0.0 112.199 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -68.4 -37.31 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.609 -0.682 . . . . 0.0 112.485 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.766 ' HD2' ' HZ2' ' A' ' 44' ' ' LYS . 10.7 m-20 -63.56 -26.14 68.56 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 171.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -76.69 -26.89 55.24 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.746 1.157 . . . . 0.0 113.52 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -62.0 -31.2 71.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.096 0.862 . . . . 0.0 110.491 170.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.2 mt -79.75 -41.93 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 124.461 1.105 . . . . 0.0 111.652 173.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 52.3 m -52.51 -42.3 64.2 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.694 1.588 . . . . 0.0 112.057 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -24.59 53.88 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -140.42 57.43 8.68 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.179 1.392 . . . . 0.0 112.781 -169.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -64.31 -23.95 65.34 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.383 2.055 . . . . 0.0 115.731 -166.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -95.15 -14.07 24.48 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.535 1.134 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -88.12 128.16 54.68 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 119.141 0.882 . . . . 0.0 112.675 -172.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -60.88 -22.79 75.26 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.641 2.227 . . . . 0.0 114.05 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.7 -30.77 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.4 1.48 . . . . 0.0 113.607 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -35.58 55.53 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.36 -1.462 . . . . 0.0 112.136 174.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -79.72 -33.85 40.54 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.572 1.149 . . . . 0.0 112.489 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.9 p -62.49 -31.08 71.77 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.223 -0.923 . . . . 0.0 112.24 169.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -77.23 -47.04 21.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.41 1.084 . . . . 0.0 111.607 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.766 ' HZ2' ' HD2' ' A' ' 28' ' ' ASP . 70.8 tttt -57.53 -35.56 70.45 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.879 1.672 . . . . 0.0 112.552 176.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.04 89.89 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 169.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 tpt -65.16 -43.25 92.39 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.636 1.175 . . . . 0.0 111.606 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.61 93.51 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.654 0.782 . . . . 0.0 112.368 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.9 mt -58.6 -41.32 85.55 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.217 0.607 . . . . 0.0 112.404 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.25 -33.14 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-N 118.961 0.8 . . . . 0.0 112.699 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -18.16 63.64 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.631 1.173 . . . . 0.0 113.197 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 tt -95.96 -39.6 9.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.345 2.258 . . . . 0.0 111.899 179.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 122.16 16.92 3.81 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.614 1.102 . . . . 0.0 115.715 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -103.02 48.4 0.86 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.746 1.619 . . . . 0.0 110.319 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -55.09 -38.1 67.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.665 1.586 . . . . 0.0 112.147 -174.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.6 m -65.97 -20.44 66.2 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 113.285 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -81.62 -40.26 23.23 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.874 -1.141 . . . . 0.0 110.978 169.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.95 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.5 pt -62.09 -33.04 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.742 0.701 . . . . 0.0 112.632 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.5 tm0? -75.83 -43.94 43.48 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.124 0.569 . . . . 0.0 111.669 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.9 tpp -54.76 -39.04 67.94 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.969 0.804 . . . . 0.0 112.568 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.36 -40.76 91.92 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.196 -0.94 . . . . 0.0 113.018 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -76.12 -28.48 57.48 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.27 1.028 . . . . 0.0 112.482 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -32.47 70.47 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.851 0.86 . . . . 0.0 112.245 166.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.57 -25.45 60.81 Favored Glycine 0 CA--C 1.536 1.364 0 O-C-N 120.321 -1.487 . . . . 0.0 113.942 174.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.86 -21.33 28.54 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.33 1.565 . . . . 0.0 112.958 166.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -72.31 4.23 3.9 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 125.556 1.542 . . . . 0.0 115.032 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -124.09 29.09 6.54 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.468 2.307 . . . . 0.0 111.947 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -127.0 12.12 7.16 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -163.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.1 p -71.55 -7.48 47.89 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -169.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.7 t -132.86 157.12 45.84 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.016 1.726 . . . . 0.0 112.135 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -48.65 -33.07 9.29 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.339 1.855 . . . . 0.0 112.84 173.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -55.94 -19.45 12.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.448 1.499 . . . . 0.0 114.065 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -131.79 17.07 4.73 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 112.453 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.5 p -71.96 -32.47 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 120.066 -1.646 . . . . 0.0 112.891 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.68 -35.32 70.24 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.239 -0.913 . . . . 0.0 111.405 171.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.1 mm -59.84 -37.37 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.988 1.715 . . . . 0.0 112.108 168.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -58.5 -33.61 70.01 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.401 1.0 . . . . 0.0 112.469 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -77.86 -41.59 36.29 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.699 0.8 . . . . 0.0 112.774 167.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -66.34 -16.99 64.5 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -92.83 -36.64 12.73 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.933 1.242 . . . . 0.0 114.051 161.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -73.1 -30.99 64.05 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.773 1.624 . . . . 0.0 113.727 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -31.17 63.89 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.592 1.087 . . . . 0.0 111.531 167.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -63.48 -34.13 77.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.121 -0.987 . . . . 0.0 111.807 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.74 -44.35 96.42 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.111 0.964 . . . . 0.0 112.079 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -68.7 -33.05 73.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.868 1.267 . . . . 0.0 111.943 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.36 -14.51 46.17 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 174.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.85 -46.27 65.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.905 1.684 . . . . 0.0 111.194 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -74.11 -6.49 47.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.75 -49.77 6.36 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.592 1.568 . . . . 0.0 113.66 162.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.89 -27.48 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.028 2.131 . . . . 0.0 113.69 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 124.357 1.063 . . . . 0.0 112.569 169.48 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.15 -38.65 72.23 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.47 -0.769 . . . . 0.0 112.9 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.58 -24.51 64.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.277 1.031 . . . . 0.0 113.379 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -73.53 -63.0 1.29 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.592 1.157 . . . . 0.0 111.378 160.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -60.83 -30.62 70.2 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -163.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -65.55 -37.42 86.65 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.101 0.96 . . . . 0.0 112.942 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -92.41 -31.33 15.34 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.558 1.072 . . . . 0.0 112.122 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -49.37 -39.56 32.56 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.313 1.445 . . . . 0.0 111.674 166.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -52.77 -43.2 60.13 Favored Glycine 0 CA--C 1.537 1.444 0 O-C-N 121.435 -0.791 . . . . 0.0 113.972 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -70.51 -38.78 74.33 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.199 1.499 . . . . 0.0 111.956 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -63.72 -31.94 73.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.278 1.031 . . . . 0.0 112.502 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.83 -37.59 79.26 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.587 -1.321 . . . . 0.0 112.332 175.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.48 -32.61 73.53 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.422 1.01 . . . . 0.0 112.245 165.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.0 10.8 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.53 1.932 . . . . 0.0 114.947 174.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -120.54 -44.55 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.781 1.633 . . . . 0.0 110.732 165.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.69 -1.68 3.61 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.19 1.376 . . . . 0.0 114.821 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.0 mt -87.26 53.56 2.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.466 1.906 . . . . 0.0 111.244 -170.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -53.71 -35.93 61.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.012 1.325 . . . . 0.0 113.36 -173.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -75.21 -33.65 61.4 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.188 0.904 . . . . 0.0 112.176 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -75.44 -29.76 59.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.167 0.894 . . . . 0.0 112.248 168.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.7 -44.55 89.88 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.127 -0.983 . . . . 0.0 111.861 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.9 t -62.83 -42.01 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.928 0.891 . . . . 0.0 111.02 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -54.28 -40.37 67.78 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.63 0.65 . . . . 0.0 112.717 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.9 m -68.97 -38.85 79.63 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.952 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.18 -35.68 76.54 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.512 1.506 . . . . 0.0 111.361 172.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.61 -22.3 65.36 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.291 1.036 . . . . 0.0 112.582 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.87 -47.92 73.29 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.904 0.775 . . . . 0.0 111.391 167.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -36.76 76.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.123 0.874 . . . . 0.0 110.619 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 55.7 mt -74.55 -21.92 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.024 0.829 . . . . 0.0 112.277 177.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.2 m -79.18 -41.66 27.87 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.431 -1.418 . . . . 0.0 111.85 171.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.19 -25.16 29.74 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -137.99 63.95 39.55 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 125.475 1.51 . . . . 0.0 111.189 -175.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -64.07 -12.1 30.67 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.76 2.973 . . . . 0.0 118.567 -165.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -122.08 3.98 9.86 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.037 0.935 . . . . 0.0 112.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.0 123.34 82.15 Favored Pre-proline 0 CA--C 1.544 0.742 0 O-C-N 120.391 -1.443 . . . . 0.0 110.329 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -63.43 -11.34 25.34 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.364 2.043 . . . . 0.0 114.461 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -53.61 -36.2 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.034 0.834 . . . . 0.0 112.42 167.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.9 -50.86 16.86 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 121.485 -0.76 . . . . 0.0 112.351 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -61.65 -40.96 96.76 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.022 0.929 . . . . 0.0 112.587 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.6 p -70.24 -21.64 62.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.091 -1.006 . . . . 0.0 113.615 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.74 -46.27 19.29 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.684 0.794 . . . . 0.0 111.412 170.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.28 -41.35 84.15 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.969 0.907 . . . . 0.0 112.568 173.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.82 -32.0 70.24 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -68.93 -44.56 72.82 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.627 -0.67 . . . . 0.0 111.127 172.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.18 82.49 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.757 0.823 . . . . 0.0 112.818 177.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.09 -47.0 81.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.364 0.666 . . . . 0.0 111.582 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.59 -29.48 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.487 1.04 . . . . 0.0 112.991 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.21 0.23 33.35 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.33 12.32 7.01 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.636 1.974 . . . . 0.0 113.687 171.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.39 15.79 79.31 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.494 1.357 . . . . 0.0 116.494 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -91.9 44.47 1.17 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.827 1.651 . . . . 0.0 112.452 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.0 -37.3 68.95 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.36 1.064 . . . . 0.0 113.03 -175.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 62.4 m -62.46 -30.06 70.98 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.88 1.272 . . . . 0.0 112.52 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -87.38 -29.32 21.6 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.001 0.52 . . . . 0.0 111.149 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.29 -41.4 73.4 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.306 1.042 . . . . 0.0 113.059 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.8 pt -60.64 -34.45 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.138 0.881 . . . . 0.0 112.029 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -68.43 -51.49 43.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.587 0.755 . . . . 0.0 111.373 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.88 -29.29 70.49 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -66.65 -43.59 84.2 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.044 -1.035 . . . . 0.0 111.998 174.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -67.99 -36.95 80.87 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.724 0.693 . . . . 0.0 111.563 175.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.62 -32.88 73.04 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.3 -0.875 . . . . 0.0 112.845 168.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.09 -23.33 66.43 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.493 -1.38 . . . . 0.0 114.402 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.47 -20.02 65.94 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.499 1.65 . . . . 0.0 112.944 171.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -65.92 -5.45 9.34 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.529 1.532 . . . . 0.0 114.58 169.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -122.37 50.25 1.5 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.913 2.085 . . . . 0.0 110.664 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -136.17 4.27 2.94 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -67.09 -29.98 69.9 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -164.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.2 p -113.1 166.27 11.58 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.115 1.366 . . . . 0.0 112.668 -169.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.01 -30.83 64.53 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.06 16.42 0.16 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -133.18 10.26 4.14 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.485 1.514 . . . . 0.0 113.577 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.4 m -63.77 -30.26 49.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 O-C-N 120.503 -1.373 . . . . 0.0 114.123 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.9 -37.23 24.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.734 0.697 . . . . 0.0 111.24 173.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -55.29 -43.98 73.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.336 1.055 . . . . 0.0 111.293 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 49.8 ttp85 -60.32 -40.12 89.45 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.082 0.953 . . . . 0.0 112.046 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -66.75 -46.54 75.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.04 0.936 . . . . 0.0 112.678 170.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -51.73 -57.52 9.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.171 0.896 . . . . 0.0 111.394 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -67.22 -28.24 67.91 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.825 1.193 . . . . 0.0 113.562 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -74.3 -45.89 44.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.848 1.204 . . . . 0.0 112.81 174.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -33.21 73.06 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.039 1.29 . . . . 0.0 111.646 176.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.9 mmt-85 -55.65 -36.96 67.61 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.42 1.009 . . . . 0.0 112.064 171.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 20.1 tp -70.01 -44.14 69.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.142 0.883 . . . . 0.0 111.92 178.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -63.96 -30.29 71.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.047 0.939 . . . . 0.0 112.983 172.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.89 -20.22 23.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.56 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.778 1.626 . . . . 0.0 110.327 168.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -69.56 -16.67 63.46 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 171.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.71 -52.22 7.39 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 125.627 1.584 . . . . 0.0 113.382 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.4 -36.41 66.02 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.598 1.559 . . . . 0.0 112.444 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.479 0.982 0 C-N-CA 123.353 0.661 . . . . 0.0 112.212 174.579 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -15.49 49.33 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -74.17 -52.19 13.24 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 157.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.08 -39.8 60.27 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.265 1.026 . . . . 0.0 112.5 -176.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -72.27 -28.34 63.05 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -81.79 -34.65 30.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.218 1.372 . . . . 0.0 112.708 173.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -75.94 -41.06 52.77 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.123 0.969 . . . . 0.0 111.222 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -59.82 -39.4 84.93 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.867 0.867 . . . . 0.0 111.275 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.18 -50.62 51.11 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-N 119.108 0.867 . . . . 0.0 112.477 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -66.24 -40.81 90.5 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.315 1.057 . . . . 0.0 111.601 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 t -57.52 -43.11 84.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.421 1.088 . . . . 0.0 112.668 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.7 mt -67.2 -35.61 79.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.92 1.288 . . . . 0.0 112.142 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -70.3 -28.13 64.94 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 172.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.86 -14.34 61.47 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.283 1.033 . . . . 0.0 112.79 171.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -98.63 -53.87 3.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.873 1.269 . . . . 0.0 112.793 176.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.65 14.95 0.99 Allowed Glycine 0 CA--C 1.537 1.46 0 N-CA-C 115.364 0.906 . . . . 0.0 115.364 -172.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.0 mt -101.61 58.01 0.85 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.285 1.834 . . . . 0.0 110.21 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.99 -36.82 85.24 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.8 1.24 . . . . 0.0 113.499 -168.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.63 -33.19 27.95 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.227 0.921 . . . . 0.0 111.279 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -63.49 -39.99 95.89 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.15 0.432 . . . . 0.0 110.558 167.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.55 -45.88 77.95 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.491 -0.755 . . . . 0.0 112.757 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.06 -35.43 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.199 173.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -61.12 -44.75 96.85 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.857 1.208 . . . . 0.0 112.166 172.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.0 m -60.14 -39.94 88.11 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.841 0.856 . . . . 0.0 112.674 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -75.0 -38.14 61.68 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 175.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -62.49 -32.21 73.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.264 0.938 . . . . 0.0 111.452 172.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -69.36 -26.73 64.82 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 174.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.49 -42.6 78.59 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.988 1.267 . . . . 0.0 110.552 166.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.6 mt -80.93 -21.39 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.022 1.329 . . . . 0.0 111.642 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.1 m -66.29 -44.38 83.67 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.241 -1.537 . . . . 0.0 110.735 168.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.77 -19.9 31.88 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.867 1.267 . . . . 0.0 114.355 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -141.45 68.6 26.05 Favored Pre-proline 0 CA--C 1.556 1.181 0 C-N-CA 125.49 1.516 . . . . 0.0 111.143 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -67.18 -22.01 47.55 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.866 2.378 . . . . 0.0 117.037 -167.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.2 tp60 -100.18 -27.12 13.68 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.616 1.166 . . . . 0.0 111.794 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -69.51 138.18 88.68 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 123.865 0.866 . . . . 0.0 112.872 -171.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.28 -20.83 62.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.909 2.406 . . . . 0.0 113.935 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -46.22 -59.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 125.244 1.418 . . . . 0.0 112.222 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.51 -34.86 85.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 118.95 -0.917 . . . . 0.0 113.432 -172.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -62.62 -42.4 99.57 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.897 1.349 . . . . 0.0 111.285 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.7 p -67.06 -25.44 66.25 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -85.19 -38.82 18.53 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.931 0.892 . . . . 0.0 112.056 172.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -63.32 -31.29 72.4 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.1 -1.625 . . . . 0.0 112.173 173.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.26 -38.61 84.04 Favored 'General case' 0 CA--C 1.548 0.904 0 O-C-N 121.007 -1.058 . . . . 0.0 113.364 169.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -64.12 -43.46 95.2 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.74 0.816 . . . . 0.0 111.17 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.96 79.43 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.334 0.654 . . . . 0.0 111.878 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.75 -38.93 92.49 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.503 -0.748 . . . . 0.0 112.751 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.4 pt -75.79 -25.86 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 CA-C-N 120.111 1.323 . . . . 0.0 113.831 174.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -19.96 39.11 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.913 1.285 . . . . 0.0 113.143 175.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 tt -80.41 -43.52 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.687 1.595 . . . . 0.0 109.854 165.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.79 32.36 4.47 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.242 0.925 . . . . 0.0 113.802 -175.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -101.71 57.42 0.83 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.761 1.624 . . . . 0.0 109.232 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -59.33 -35.05 73.11 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.494 -0.754 . . . . 0.0 111.917 -170.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 88.4 m -62.08 -29.91 70.64 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.114 0.966 . . . . 0.0 112.785 174.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -81.57 -34.54 31.01 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 111.453 171.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.36 98.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.24 -0.913 . . . . 0.0 112.881 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.9 pt -64.33 -30.44 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.299 0.639 . . . . 0.0 112.681 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -71.08 -51.21 26.52 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.475 0.71 . . . . 0.0 110.767 170.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.6 ttm -63.51 -34.04 76.9 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -175.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.3 m -69.76 -42.64 73.58 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.17 -0.956 . . . . 0.0 112.053 175.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.17 -37.16 80.68 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.011 0.823 . . . . 0.0 112.078 177.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -39.92 92.53 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.332 1.053 . . . . 0.0 111.867 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.41 -23.92 77.49 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.229 -1.544 . . . . 0.0 114.233 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.2 mt -66.93 -25.75 66.51 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.959 1.379 . . . . 0.0 112.348 169.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.78 -48.34 82.06 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.142 0.883 . . . . 0.0 111.24 170.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -64.24 -28.1 69.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.255 1.022 . . . . 0.0 113.351 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.5 p -118.64 -1.4 11.15 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -158.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -78.68 49.79 0.92 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.579 1.152 . . . . 0.0 112.825 177.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 t -157.46 153.46 27.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.622 1.569 . . . . 0.0 112.025 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.06 -35.59 25.8 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -164.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.52 -2.82 47.67 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -133.62 12.26 4.08 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.957 1.703 . . . . 0.0 113.098 -173.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.49 -24.86 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.74 -37.22 59.53 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.427 1.012 . . . . 0.0 111.133 171.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mm -65.6 -33.86 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.284 1.033 . . . . 0.0 111.186 173.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -57.41 -44.5 84.65 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.909 1.284 . . . . 0.0 111.401 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 m -66.55 -34.5 78.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.923 0.889 . . . . 0.0 112.56 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -68.9 -0.6 5.75 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 170.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.98 -33.39 6.93 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 117.522 -1.228 . . . . 0.0 113.405 156.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -54.6 -54.64 38.69 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.238 1.835 . . . . 0.0 112.092 173.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -30.17 67.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 122.08 -0.388 . . . . 0.0 111.452 -172.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -64.83 -40.3 94.96 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.35 -0.844 . . . . 0.0 111.563 170.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.57 -30.75 68.61 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.968 0.907 . . . . 0.0 112.159 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -68.69 -47.45 66.41 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.006 0.523 . . . . 0.0 112.063 165.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.88 -16.09 62.67 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.095 -1.003 . . . . 0.0 113.694 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.46 93.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.437 1.471 . . . . 0.0 111.327 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.58 -27.47 65.14 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 121.47 0.652 . . . . 0.0 112.038 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.67 -47.15 42.61 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.349 1.452 . . . . 0.0 112.782 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.17 -32.68 44.3 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.02 1.728 . . . . 0.0 113.218 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.478 0.96 0 CA-C-N 118.953 0.797 . . . . 0.0 111.112 170.791 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -13.2 59.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 174.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -77.81 -48.33 16.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 120.96 -1.087 . . . . 0.0 108.636 163.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -46.74 65.04 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.256 1.022 . . . . 0.0 111.974 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -66.92 -25.96 66.62 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.5 ptpp? -86.95 -30.97 20.91 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.987 1.267 . . . . 0.0 113.589 174.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -76.92 -31.85 56.95 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.968 0.803 . . . . 0.0 111.185 173.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -57.66 -52.62 64.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.624 1.57 . . . . 0.0 110.776 159.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.13 -45.97 71.59 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.175 0.898 . . . . 0.0 113.746 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -52.09 66.47 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.936 1.294 . . . . 0.0 111.479 173.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.4 m -60.15 -47.88 84.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.9 0.88 . . . . 0.0 111.379 -178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -55.71 -35.65 66.32 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.727 1.211 . . . . 0.0 112.044 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -66.48 -41.66 88.64 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 120.069 1.304 . . . . 0.0 113.997 173.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -42.19 99.37 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 119.262 0.937 . . . . 0.0 111.833 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -72.35 -25.16 61.43 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.85 12.88 15.08 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.263 1.411 . . . . 0.0 116.055 171.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.2 mt -97.81 61.8 1.59 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.93 2.092 . . . . 0.0 111.047 -174.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -59.26 -30.52 68.35 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.642 1.177 . . . . 0.0 113.986 -175.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -84.31 -32.24 24.44 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.015 -1.053 . . . . 0.0 111.463 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -65.61 -42.79 91.21 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.821 164.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.08 -48.49 70.8 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.479 -0.763 . . . . 0.0 112.405 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 49.6 t -60.34 -33.48 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.574 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -59.68 -43.69 93.9 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.026 1.285 . . . . 0.0 112.592 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.3 m -70.3 -34.03 72.24 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.721 -0.612 . . . . 0.0 112.313 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -72.89 -40.2 65.75 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.877 0.871 . . . . 0.0 112.901 172.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -58.76 -36.06 73.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.546 1.138 . . . . 0.0 111.263 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.33 -14.45 60.1 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.67 -39.98 95.68 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.13 1.332 . . . . 0.0 110.251 161.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.9 mt -75.56 -44.59 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 m -60.1 -33.47 72.15 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.771 1.169 . . . . 0.0 112.286 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.39 -22.09 44.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -144.55 61.12 8.28 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.085 1.354 . . . . 0.0 111.802 -170.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -64.99 -20.52 64.05 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.353 2.035 . . . . 0.0 117.164 -158.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -113.27 3.26 15.88 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.074 0.95 . . . . 0.0 112.237 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -82.01 127.12 73.11 Favored Pre-proline 0 CA--C 1.541 0.608 0 O-C-N 120.717 -1.239 . . . . 0.0 111.613 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.39 -14.79 44.38 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 122.347 2.031 . . . . 0.0 113.806 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.58 -36.98 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-N 119.739 1.154 . . . . 0.0 112.287 170.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.38 -50.16 28.22 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 121.099 -1.0 . . . . 0.0 111.717 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -66.73 -38.56 86.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.303 1.041 . . . . 0.0 112.967 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.7 p -69.58 -14.46 62.85 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 173.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -91.81 -41.4 10.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.276 1.031 . . . . 0.0 111.946 168.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.37 -36.77 83.3 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.793 -1.192 . . . . 0.0 112.396 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.76 -35.3 76.05 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.327 -0.858 . . . . 0.0 113.021 170.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.6 tpt -68.85 -41.87 77.88 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.828 0.851 . . . . 0.0 111.657 175.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -46.11 84.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.746 0.819 . . . . 0.0 111.286 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.6 mt -59.57 -35.82 75.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.66 0.784 . . . . 0.0 112.951 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.5 pt -84.07 -17.78 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.01 -14.92 53.05 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.674 1.19 . . . . 0.0 112.429 168.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.5 tt -94.3 -50.61 5.18 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.924 2.489 . . . . 0.0 111.579 175.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.88 15.95 2.51 Favored Glycine 0 CA--C 1.54 1.646 0 N-CA-C 116.4 1.32 . . . . 0.0 116.4 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -105.31 53.69 0.71 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.413 1.485 . . . . 0.0 110.002 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.87 -29.55 69.61 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.032 -1.042 . . . . 0.0 112.998 -173.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.5 m -60.74 -29.8 69.6 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.953 0.797 . . . . 0.0 111.912 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -76.36 -36.33 58.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.106 0.562 . . . . 0.0 111.445 172.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.32 -37.93 74.83 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.8 pt -65.08 -33.32 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.896 0.771 . . . . 0.0 111.973 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.0 tm0? -68.6 -45.8 71.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.45 0.7 . . . . 0.0 110.818 171.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.9 ttm -73.77 -31.2 63.18 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -173.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.9 m -66.76 -39.91 88.04 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.907 -1.121 . . . . 0.0 111.464 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -67.48 -37.66 83.23 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.442 -0.786 . . . . 0.0 112.008 173.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.32 -31.93 72.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.284 0.634 . . . . 0.0 111.989 171.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.93 -24.56 64.06 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 120.241 1.382 . . . . 0.0 114.391 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.4 mt -62.3 -22.16 65.82 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.648 1.724 . . . . 0.0 112.253 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.68 -2.44 2.45 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 169.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -120.81 40.59 3.5 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.052 1.741 . . . . 0.0 111.665 -175.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 34.3 p -135.9 7.44 3.21 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 116.857 2.169 . . . . 0.0 116.857 -164.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 95.3 p -83.38 19.05 1.62 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -172.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -142.81 144.62 32.63 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.609 1.964 . . . . 0.0 109.61 177.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.79 -9.79 31.65 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.031 0.932 . . . . 0.0 113.465 176.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -59.12 -23.69 62.34 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.399 1.08 . . . . 0.0 112.309 164.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -129.92 24.22 5.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.937 2.095 . . . . 0.0 112.675 -176.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.06 -34.46 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 O-C-N 119.958 -1.714 . . . . 0.0 111.996 173.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.0 79.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.521 -0.737 . . . . 0.0 111.44 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.1 mm -65.13 -37.11 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.43 1.092 . . . . 0.0 111.184 170.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -59.57 -40.21 86.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.702 0.801 . . . . 0.0 111.997 177.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.6 t -70.04 -46.49 64.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.218 1.007 . . . . 0.0 112.162 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -72.05 -3.95 25.94 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -175.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -101.58 -33.13 10.04 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.064 1.302 . . . . 0.0 113.705 158.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -67.75 -49.71 61.04 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 120.381 1.446 . . . . 0.0 112.723 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -34.17 77.31 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.878 1.217 . . . . 0.0 111.19 174.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -65.04 -31.65 72.99 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.86 -1.15 . . . . 0.0 112.116 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.9 tp -71.63 -37.96 70.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.299 1.04 . . . . 0.0 112.774 169.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.03 -36.92 83.05 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.757 -0.589 . . . . 0.0 111.438 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.56 -25.49 35.8 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.889 -1.132 . . . . 0.0 113.259 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.72 99.89 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.47 1.486 . . . . 0.0 111.408 167.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -64.63 -27.18 68.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.801 0.84 . . . . 0.0 112.211 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.52 -46.04 57.09 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 125.688 1.613 . . . . 0.0 113.605 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.64 -28.79 61.02 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.6 1.16 . . . . 0.0 113.094 -177.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.7 p . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 178.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 119.698 -0.191 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -63.7 -37.22 86.53 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.425 -0.797 . . . . 0.0 112.835 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -72.21 -17.76 61.9 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.18 -28.32 16.35 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.3 -36.23 68.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.471 1.032 . . . . 0.0 112.512 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -60.1 -33.67 72.43 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.072 0.851 . . . . 0.0 111.344 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.62 -34.02 62.7 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.678 0.791 . . . . 0.0 113.041 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -64.74 -42.83 94.88 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.316 -0.865 . . . . 0.0 111.435 168.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.87 -41.83 99.39 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 121.669 -0.644 . . . . 0.0 112.482 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -58.74 -38.43 78.39 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.784 -0.833 . . . . 0.0 112.544 172.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -68.83 -42.46 77.17 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.683 0.674 . . . . 0.0 111.901 175.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -56.76 -40.45 75.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.868 1.213 . . . . 0.0 112.438 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -58.14 -39.07 77.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.857 0.753 . . . . 0.0 112.322 171.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.56 65.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -84.86 4.46 33.13 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.226 0.921 . . . . 0.0 113.157 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.75 4.57 90.01 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-O 119.142 -0.81 . . . . 0.0 114.151 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.8 mt -84.62 54.04 2.89 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.313 1.557 . . . . 0.0 111.622 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -57.35 -32.25 66.56 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.897 1.279 . . . . 0.0 113.306 -173.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -83.59 -23.95 31.71 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.336 1.426 . . . . 0.0 113.039 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -75.76 -36.8 59.75 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.277 0.944 . . . . 0.0 111.21 164.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.76 -38.1 58.66 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.0 t -64.88 -35.56 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 O-C-N 120.626 -1.296 . . . . 0.0 110.885 170.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -59.88 -33.36 71.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.032 0.833 . . . . 0.0 112.267 171.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.6 m -64.64 -36.19 83.46 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.465 173.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.336 0.2 OUTLIER -66.11 -29.82 70.2 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.491 1.496 . . . . 0.0 114.249 -178.826 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.59 -36.12 80.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.317 0.962 . . . . 0.0 112.096 172.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -61.62 -34.15 75.15 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.763 0.711 . . . . 0.0 112.659 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.41 -37.08 85.88 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 121.711 -0.618 . . . . 0.0 110.873 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.7 mt -82.18 -35.81 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 110.444 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.8 m -63.37 -31.66 72.88 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.4 1.454 . . . . 0.0 112.628 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.13 -29.37 57.79 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 169.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -134.65 61.81 50.59 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 124.838 1.255 . . . . 0.0 112.286 -169.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -64.04 -25.4 66.27 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.601 2.201 . . . . 0.0 117.279 -160.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -120.06 23.34 11.05 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.538 1.135 . . . . 0.0 111.728 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -106.44 123.29 39.28 Favored Pre-proline 0 CA--C 1.544 0.734 0 O-C-N 121.182 -0.949 . . . . 0.0 112.824 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.401 ' HA ' ' CD2' ' A' ' 41' ' ' TYR . 19.0 Cg_endo -59.97 -13.64 24.03 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.116 2.544 . . . . 0.0 115.983 174.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.16 -37.77 57.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 120.262 1.392 . . . . 0.0 112.663 166.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.17 -44.49 60.04 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.647 0.658 . . . . 0.0 111.573 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 38' ' ' PRO . 3.4 m-30 -65.32 -37.73 88.0 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.874 -0.78 . . . . 0.0 111.628 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 37.3 m -59.99 -37.55 80.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.455 1.102 . . . . 0.0 111.884 171.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -81.47 -24.99 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.84 -40.82 92.1 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.971 -1.081 . . . . 0.0 111.614 163.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.25 -38.95 93.15 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.107 0.867 . . . . 0.0 112.596 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.1 tpt -60.41 -43.11 97.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.635 1.174 . . . . 0.0 112.043 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.21 -44.05 95.46 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.561 1.073 . . . . 0.0 112.417 172.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.5 mt -61.39 -44.57 96.92 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.536 0.734 . . . . 0.0 112.419 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -70.27 -29.0 37.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 119.432 1.014 . . . . 0.0 112.716 175.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -10.76 59.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -7.06 23.41 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.798 2.039 . . . . 0.0 112.55 167.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.21 14.21 75.01 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.7 1.143 . . . . 0.0 115.767 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -90.15 51.16 1.98 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.389 1.476 . . . . 0.0 110.769 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -55.35 -37.4 67.44 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.086 1.354 . . . . 0.0 112.467 -173.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.4 m -65.03 -22.84 67.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.993 1.317 . . . . 0.0 113.546 177.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -81.23 -39.5 25.26 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 110.769 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -37.41 87.04 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.596 -0.69 . . . . 0.0 112.707 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.0 pt -63.07 -33.17 59.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 113.127 177.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -72.68 -47.9 43.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.626 0.648 . . . . 0.0 110.969 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 29.0 ttm -63.58 -31.88 73.18 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 82.9 m -69.18 -39.93 78.42 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.121 -0.987 . . . . 0.0 111.798 174.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -69.4 -36.26 76.58 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.449 -0.782 . . . . 0.0 111.256 174.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -30.74 69.06 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.724 -1.235 . . . . 0.0 112.701 167.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.18 -31.69 54.38 Favored Glycine 0 N--CA 1.47 0.913 0 CA-C-N 120.612 1.551 . . . . 0.0 113.573 171.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.54 -28.92 70.27 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.34 1.57 . . . . 0.0 112.325 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -58.3 -16.04 12.65 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -88.65 2.8 52.55 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.223 1.409 . . . . 0.0 113.424 173.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -114.27 80.27 1.37 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -167.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.1 m -134.64 7.07 3.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.943 1.297 . . . . 0.0 114.151 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -143.02 161.13 38.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.389 1.475 . . . . 0.0 112.197 -173.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.0 -5.92 29.79 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -164.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.25 9.71 42.35 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 120.581 -1.324 . . . . 0.0 114.419 173.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -135.96 11.33 3.35 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.1 m -70.13 -35.57 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 120.183 -1.573 . . . . 0.0 114.236 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.47 -29.39 46.8 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.975 -1.078 . . . . 0.0 111.457 171.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.5 mm -58.33 -35.03 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 121.515 -0.741 . . . . 0.0 111.447 165.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttt-85 -57.39 -46.74 83.12 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.441 1.019 . . . . 0.0 110.715 173.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 75.3 m -64.69 -37.31 87.13 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.407 1.083 . . . . 0.0 113.591 171.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -57.18 -48.99 77.37 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.275 0.943 . . . . 0.0 110.842 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.93 -25.59 56.11 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 117.303 -1.332 . . . . 0.0 113.775 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -58.06 -53.8 54.16 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 120.855 1.662 . . . . 0.0 110.41 166.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -30.03 60.78 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -58.42 -37.42 75.33 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.812 1.187 . . . . 0.0 112.103 169.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.92 -39.99 69.08 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.827 0.739 . . . . 0.0 112.098 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -58.02 -39.88 79.45 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.548 -0.72 . . . . 0.0 112.167 169.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.2 -19.46 33.98 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 120.965 -1.084 . . . . 0.0 113.771 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.42 -37.54 77.49 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.488 1.495 . . . . 0.0 111.373 164.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -69.11 -29.4 67.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.951 0.9 . . . . 0.0 111.826 169.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -55.3 13.84 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 126.374 1.94 . . . . 0.0 112.107 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.65 -27.72 65.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.123 1.369 . . . . 0.0 113.637 -174.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 N--CA 1.482 1.172 0 CA-C-N 119.056 0.844 . . . . 0.0 112.61 172.79 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.218 0.532 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -40.91 91.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.358 1.063 . . . . 0.0 111.358 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.663 ' HE2' ' HZ3' ' A' ' 8' ' ' LYS . 24.2 mm-40 -61.2 -25.44 67.04 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.172 1.389 . . . . 0.0 113.161 171.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.7 -47.62 18.7 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.129 0.972 . . . . 0.0 111.49 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.66 -31.7 68.72 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.663 ' HZ3' ' HE2' ' A' ' 5' ' ' GLU . 16.5 ptpt -58.58 -35.02 71.73 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.298 0.954 . . . . 0.0 112.991 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.56 -21.25 20.19 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.68 -42.12 98.5 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.561 171.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.84 -36.96 91.73 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-O 119.218 -0.768 . . . . 0.0 114.224 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -57.15 -46.34 82.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.857 1.329 . . . . 0.0 111.989 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -67.54 -43.42 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.153 0.981 . . . . 0.0 111.748 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.21 -42.95 87.32 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.443 -0.786 . . . . 0.0 111.736 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.07 -40.0 83.84 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.918 -1.114 . . . . 0.0 112.447 170.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -33.91 77.04 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.45 1.1 . . . . 0.0 113.659 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.48 -9.49 59.62 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 18.72 55.46 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.046 -1.033 . . . . 0.0 114.621 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 mt -93.28 55.0 2.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.178 2.191 . . . . 0.0 110.002 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 -61.5 -38.89 88.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -167.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.28 -38.47 65.89 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.145 0.884 . . . . 0.0 110.917 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -66.02 -34.86 79.04 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 122.974 0.509 . . . . 0.0 111.967 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.39 -53.15 53.04 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.952 0.501 . . . . 0.0 111.986 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.2 t -63.26 -32.34 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.665 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -53.82 -51.47 63.43 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.175 0.898 . . . . 0.0 111.416 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 99.7 m -57.89 -40.2 79.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.083 0.953 . . . . 0.0 112.204 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -70.47 -41.25 73.0 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.717 0.689 . . . . 0.0 112.659 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.889 ' HD2' ' HZ3' ' A' ' 44' ' ' LYS . 35.3 m-20 -67.34 -25.52 66.04 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.896 0.771 . . . . 0.0 112.492 174.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -65.38 -32.0 73.4 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.342 -1.474 . . . . 0.0 111.767 169.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -68.03 -38.75 82.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.075 0.852 . . . . 0.0 110.919 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.9 mm -68.29 -37.23 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.697 0.799 . . . . 0.0 110.595 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.1 m -59.93 -32.49 70.83 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.951 1.3 . . . . 0.0 112.708 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.41 -16.85 20.99 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -138.36 51.56 3.91 Favored Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 123.958 0.903 . . . . 0.0 112.707 -166.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -61.62 -27.09 81.08 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.383 2.055 . . . . 0.0 116.803 -159.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -102.38 0.5 34.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -83.11 118.85 72.94 Favored Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.028 -1.045 . . . . 0.0 112.361 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -54.34 -25.42 39.1 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.079 2.519 . . . . 0.0 114.852 174.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -52.48 -44.61 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.058 0.943 . . . . 0.0 112.376 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -44.83 60.83 Favored Glycine 0 CA--C 1.528 0.876 0 O-C-N 121.56 -0.713 . . . . 0.0 112.359 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -60.78 -33.73 73.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.465 0.706 . . . . 0.0 111.859 173.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.0 t -68.43 -41.63 80.07 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.264 -0.897 . . . . 0.0 113.092 172.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -64.87 -35.37 80.92 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 118.676 0.671 . . . . 0.0 111.294 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.889 ' HZ3' ' HD2' ' A' ' 28' ' ' ASP . 78.4 tttt -73.37 -31.65 64.05 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.785 -1.197 . . . . 0.0 112.767 175.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.28 93.93 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.868 -1.145 . . . . 0.0 112.224 168.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 43.4 tpp -59.0 -40.5 85.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.051 0.941 . . . . 0.0 111.609 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.68 91.74 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.516 -0.74 . . . . 0.0 112.776 174.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.9 mt -66.14 -36.35 82.89 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.531 -0.731 . . . . 0.0 112.691 -176.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.6 pt -71.61 -28.8 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.737 1.153 . . . . 0.0 112.966 171.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.34 -20.85 36.49 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 tt -81.16 -32.82 33.49 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.286 1.434 . . . . 0.0 110.528 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.45 21.0 10.22 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.26 1.41 . . . . 0.0 114.842 175.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -96.11 57.86 1.79 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.875 1.338 . . . . 0.0 110.058 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -54.55 -37.86 65.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.854 1.262 . . . . 0.0 112.603 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.72 -23.28 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.245 1.018 . . . . 0.0 112.566 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -87.84 -31.72 19.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.826 0.85 . . . . 0.0 111.884 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -40.3 88.14 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.624 0.769 . . . . 0.0 112.162 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.1 pt -62.2 -38.96 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 118.828 0.74 . . . . 0.0 112.011 177.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.83 -44.69 92.45 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.688 0.795 . . . . 0.0 111.177 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.5 ttm -65.23 -31.35 72.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.784 0.72 . . . . 0.0 112.928 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.2 m -69.45 -42.82 74.41 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.994 -1.066 . . . . 0.0 111.817 174.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -62.11 -41.53 98.32 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.723 0.692 . . . . 0.0 111.947 172.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -34.95 77.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.453 1.101 . . . . 0.0 111.797 172.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.38 -30.33 56.91 Favored Glycine 0 CA--C 1.532 1.107 0 O-C-N 120.651 -1.28 . . . . 0.0 114.393 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.59 -30.02 68.38 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.58 1.69 . . . . 0.0 111.949 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -63.85 -16.7 61.96 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -92.57 34.71 1.05 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.164 1.385 . . . . 0.0 113.045 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.9 p -144.21 137.78 27.6 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 120.511 -1.368 . . . . 0.0 114.055 -166.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.7 t -163.73 -50.34 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 163.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -85.47 175.73 8.66 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.714 0.806 . . . . 0.0 112.895 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.01 -10.62 51.73 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -170.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -2.03 42.59 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.081 -1.012 . . . . 0.0 113.394 167.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -120.65 -9.46 9.36 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.285 1.434 . . . . 0.0 114.436 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -68.59 -31.21 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 O-C-N 119.845 -1.784 . . . . 0.0 113.535 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.02 -37.67 64.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.19 0.904 . . . . 0.0 111.649 165.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -57.08 -32.91 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.376 -0.828 . . . . 0.0 112.979 175.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.3 mtm180 -61.79 -44.74 96.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.191 0.996 . . . . 0.0 112.006 174.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.3 t -65.66 -38.78 90.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 118.747 0.703 . . . . 0.0 111.485 169.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -73.0 7.26 2.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.42 1.488 . . . . 0.0 114.367 176.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -114.83 -33.25 5.53 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.527 1.058 . . . . 0.0 112.629 153.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -68.13 -41.29 81.9 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 120.455 1.48 . . . . 0.0 114.116 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.59 78.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.434 -1.417 . . . . 0.0 111.191 173.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -60.93 -37.02 80.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.488 -0.758 . . . . 0.0 111.122 174.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 38.3 tp -70.21 -40.87 74.31 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.067 1.347 . . . . 0.0 112.441 174.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.99 -31.31 72.45 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.39 -0.819 . . . . 0.0 112.609 171.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -88.35 -22.84 23.6 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.25 95.86 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.596 1.544 . . . . 0.0 110.183 165.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -71.59 -31.91 67.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.477 1.111 . . . . 0.0 112.146 173.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.61 -47.18 63.47 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.26 1.409 . . . . 0.0 113.545 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.33 -26.29 60.06 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.261 1.424 . . . . 0.0 113.12 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.4 p . . . . . 0 N--CA 1.476 0.842 0 CA-C-N 119.022 0.828 . . . . 0.0 112.481 173.969 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 CA--C 1.54 0.571 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -92.66 -0.12 57.34 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 175.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -97.12 -37.95 9.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.212 1.805 . . . . 0.0 111.582 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -39.5 93.8 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.898 0.772 . . . . 0.0 111.499 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.85 -24.09 62.46 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -172.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -76.45 -36.62 57.82 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.185 -0.947 . . . . 0.0 112.942 171.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -66.24 -36.07 82.07 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.556 0.743 . . . . 0.0 112.261 170.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -63.65 -50.46 69.2 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.236 1.414 . . . . 0.0 111.088 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.84 -40.18 80.05 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.606 -0.684 . . . . 0.0 113.731 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.49 -37.72 83.27 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 118.765 1.282 . . . . 0.0 111.983 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 t -65.06 -46.03 82.89 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.228 0.611 . . . . 0.0 112.113 171.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.9 mt -57.68 -38.9 75.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.257 1.023 . . . . 0.0 111.996 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -56.59 -41.36 76.85 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.797 -0.564 . . . . 0.0 112.39 170.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -19.43 64.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.534 1.134 . . . . 0.0 113.901 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -91.84 -5.59 53.13 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.587 1.085 . . . . 0.0 113.693 168.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 11.35 72.1 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.15 -0.969 . . . . 0.0 114.526 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.5 mt -83.67 51.12 1.94 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.779 1.631 . . . . 0.0 110.616 175.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -55.76 -36.0 66.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.943 1.697 . . . . 0.0 112.85 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -86.94 -33.69 19.6 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.377 -0.827 . . . . 0.0 112.202 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -62.64 -41.02 98.8 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 118.511 0.596 . . . . 0.0 111.431 164.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.39 80.67 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.46 -35.15 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.729 -0.607 . . . . 0.0 111.205 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -62.63 -39.01 92.48 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.403 1.001 . . . . 0.0 112.029 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -64.77 -44.85 88.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.876 0.871 . . . . 0.0 111.781 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -63.06 -38.4 91.03 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.654 -0.654 . . . . 0.0 112.079 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.11 -26.45 68.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.641 1.176 . . . . 0.0 112.368 171.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -72.45 -27.68 62.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.302 1.41 . . . . 0.0 112.969 172.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.42 -44.0 92.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.728 1.149 . . . . 0.0 110.473 170.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.0 mt -66.32 -44.28 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.916 1.286 . . . . 0.0 110.103 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -61.01 -30.14 70.12 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.24 1.016 . . . . 0.0 112.384 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.77 -28.28 30.46 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 173.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -140.71 65.69 25.54 Favored Pre-proline 0 CA--C 1.562 1.409 0 C-N-CA 126.382 1.873 . . . . 0.0 111.552 -168.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -68.35 -19.19 43.96 Favored 'Trans proline' 0 C--N 1.353 0.806 0 N-CA-C 118.179 2.338 . . . . 0.0 118.179 -161.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -102.73 -8.66 20.67 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.381 -0.824 . . . . 0.0 112.736 177.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -77.3 140.76 65.55 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 121.21 -0.931 . . . . 0.0 112.352 -174.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.33 -9.01 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.541 2.161 . . . . 0.0 113.871 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 p -61.74 -46.16 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.948 -1.095 . . . . 0.0 112.233 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.13 -36.1 64.13 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 120.918 -1.114 . . . . 0.0 113.168 175.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -58.3 -39.68 79.96 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.707 1.254 . . . . 0.0 111.492 169.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.5 m -62.02 -29.98 70.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.716 0.806 . . . . 0.0 112.207 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -87.86 -29.45 20.9 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -63.16 -39.78 95.65 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 121.174 1.807 . . . . 0.0 111.205 165.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -34.1 75.86 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.904 -1.123 . . . . 0.0 112.925 169.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 tpt -63.75 -40.18 96.1 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.604 0.762 . . . . 0.0 111.724 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.94 86.96 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.708 0.685 . . . . 0.0 111.869 171.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -56.56 -41.7 77.32 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.42 1.009 . . . . 0.0 112.294 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.7 pt -76.1 -21.05 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.42 -15.7 22.81 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.031 1.287 . . . . 0.0 114.108 178.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.95 -28.4 15.82 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.455 1.902 . . . . 0.0 111.294 169.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.0 27.12 6.39 Favored Glycine 0 CA--C 1.531 1.078 0 N-CA-C 115.755 1.062 . . . . 0.0 115.755 173.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.02 54.49 1.12 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.385 1.088 . . . . 0.0 109.927 170.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -58.94 -32.79 69.91 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.726 1.21 . . . . 0.0 113.408 -169.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.8 m -75.12 -22.0 58.51 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.458 -0.776 . . . . 0.0 112.099 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.5 mm-40 -74.47 -36.57 63.31 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.58 -1.325 . . . . 0.0 110.931 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.66 -41.96 91.89 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.649 -0.657 . . . . 0.0 112.537 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.7 pt -61.63 -36.96 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.561 0.619 . . . . 0.0 111.998 176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -66.39 -50.33 63.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.297 1.039 . . . . 0.0 110.804 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.9 ttm -63.8 -32.3 73.77 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.1 -42.41 72.74 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 120.867 -1.145 . . . . 0.0 112.093 175.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -71.73 -33.53 68.8 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.112 0.869 . . . . 0.0 111.79 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -36.86 77.84 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.335 1.054 . . . . 0.0 112.418 164.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.26 -29.8 61.71 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 120.266 -1.521 . . . . 0.0 113.902 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.51 -21.8 62.86 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.558 1.679 . . . . 0.0 112.626 172.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -66.11 -9.18 28.81 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 170.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -109.23 27.75 9.21 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.762 2.025 . . . . 0.0 111.985 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 32.1 p -135.18 -0.78 2.69 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 -166.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 69.5 m -79.44 40.51 0.44 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.831 -1.168 . . . . 0.0 113.014 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 t -150.9 145.57 25.72 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.9 -13.53 11.35 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.981 1.312 . . . . 0.0 114.169 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -70.07 -28.04 65.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.769 1.228 . . . . 0.0 112.416 168.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -134.84 21.4 3.54 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.988 1.715 . . . . 0.0 112.697 -169.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.63 -35.22 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 120.642 -1.286 . . . . 0.0 112.168 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.0 68.19 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.21 -0.931 . . . . 0.0 111.784 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.0 mm -67.68 -31.81 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.154 -0.966 . . . . 0.0 111.018 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -57.2 -40.87 78.3 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.248 -0.908 . . . . 0.0 111.441 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.9 m -76.96 -35.45 57.22 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.351 1.46 . . . . 0.0 113.603 174.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -52.36 -63.46 1.13 Allowed 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.779 1.172 . . . . 0.0 110.74 168.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -70.52 -26.63 63.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.073 0.851 . . . . 0.0 112.737 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.81 -35.31 64.87 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.04 1.291 . . . . 0.0 114.012 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.6 65.48 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.965 1.257 . . . . 0.0 111.343 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 57.3 mmt-85 -56.1 -42.93 77.56 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 119.575 1.08 . . . . 0.0 111.406 170.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.7 tp -67.54 -40.68 85.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.801 1.24 . . . . 0.0 112.469 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.63 -37.08 85.97 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.95 0.5 . . . . 0.0 112.31 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.2 -20.78 31.76 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.64 -47.81 83.14 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.281 1.4 . . . . 0.0 110.669 169.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.02 -26.96 57.15 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 173.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -25.94 74.22 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 120.82 -1.175 . . . . 0.0 114.78 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -87.46 -33.7 18.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.92 1.288 . . . . 0.0 112.873 174.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.7 p . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -173.749 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 N--CA 1.467 0.408 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -7.66 56.9 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -87.57 -47.85 8.38 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.938 1.295 . . . . 0.0 111.078 170.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -27.73 67.9 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.773 -1.204 . . . . 0.0 112.608 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -28.15 63.7 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.101 1.319 . . . . 0.0 114.042 175.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -76.02 -30.27 58.43 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.687 -1.258 . . . . 0.0 111.369 171.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -71.29 -30.54 66.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 169.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.24 -48.6 81.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.188 0.995 . . . . 0.0 109.743 163.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.2 -38.91 57.39 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.896 0.76 . . . . 0.0 113.738 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -60.51 -47.86 84.32 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.432 1.116 . . . . 0.0 112.317 176.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.8 m -66.3 -36.22 82.4 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.355 0.662 . . . . 0.0 112.599 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -61.14 -44.69 96.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.258 -0.901 . . . . 0.0 111.055 175.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -58.89 -39.73 82.31 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.349 0.977 . . . . 0.0 112.656 169.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -27.93 65.88 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -84.75 -19.74 32.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.454 1.501 . . . . 0.0 113.07 170.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 9.69 38.22 Favored Glycine 0 N--CA 1.477 1.398 0 C-N-CA 125.256 1.408 . . . . 0.0 114.353 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.0 mt -87.41 55.74 3.65 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 127.734 2.414 . . . . 0.0 110.031 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -57.77 -40.2 79.23 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.429 1.092 . . . . 0.0 112.566 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -67.98 -39.34 83.31 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.144 0.884 . . . . 0.0 110.836 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.34 -33.14 71.12 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.255 1.022 . . . . 0.0 113.36 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.26 77.14 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.133 0.879 . . . . 0.0 112.377 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.86 -34.84 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.446 1.099 . . . . 0.0 111.402 174.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 -58.17 -33.85 69.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.286 0.948 . . . . 0.0 112.654 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 70.3 m -69.09 -46.15 68.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.803 0.729 . . . . 0.0 111.524 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -31.59 72.46 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.628 1.104 . . . . 0.0 112.067 174.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.51 -29.51 70.77 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.198 -0.939 . . . . 0.0 112.454 174.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -70.97 -30.45 66.72 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.396 0.998 . . . . 0.0 112.302 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.88 -54.01 47.9 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.849 0.75 . . . . 0.0 110.008 171.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 58.1 mt -73.94 -28.77 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 111.846 -171.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -71.06 -27.21 63.47 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 120.913 -1.117 . . . . 0.0 112.287 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.94 -25.75 27.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 168.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -143.77 78.09 14.49 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.729 1.611 . . . . 0.0 112.213 -166.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -67.1 -22.13 47.89 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.742 2.295 . . . . 0.0 115.575 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -133.98 -11.75 2.59 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -163.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -65.91 128.78 94.06 Favored Pre-proline 0 CA--C 1.547 0.857 0 O-C-N 120.604 -1.31 . . . . 0.0 108.644 164.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.62 -22.45 72.66 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.739 2.292 . . . . 0.0 114.063 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.18 -31.64 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.782 1.633 . . . . 0.0 114.23 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.65 -35.03 62.62 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.153 -0.967 . . . . 0.0 112.214 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -79.01 -37.3 39.5 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.193 0.997 . . . . 0.0 112.279 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.0 p -64.47 -30.41 71.44 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.5 -0.75 . . . . 0.0 112.835 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -79.43 -40.21 30.52 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 172.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -57.52 -40.49 78.88 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.151 0.887 . . . . 0.0 111.818 171.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.32 80.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 172.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -45.85 78.91 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.437 0.695 . . . . 0.0 111.935 172.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.78 -42.74 84.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.368 0.667 . . . . 0.0 111.512 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.99 -43.59 98.63 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.316 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.2 pt -72.47 -27.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 120.771 1.623 . . . . 0.0 113.585 175.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.5 -17.53 56.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.916 0.887 . . . . 0.0 113.164 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.26 -17.43 26.0 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.806 2.042 . . . . 0.0 112.02 166.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.89 29.97 21.91 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.023 1.297 . . . . 0.0 115.044 178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.65 52.57 0.83 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.977 2.511 . . . . 0.0 109.628 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -58.92 -36.93 75.55 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 120.942 -1.099 . . . . 0.0 112.434 -170.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 m -62.05 -22.67 65.94 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.106 0.962 . . . . 0.0 113.405 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -81.29 -36.34 29.94 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.962 -1.086 . . . . 0.0 111.714 171.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.15 -38.5 78.83 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.8 pt -66.94 -30.84 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.706 0.802 . . . . 0.0 113.012 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -66.0 -49.72 66.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.292 0.637 . . . . 0.0 110.791 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 25.5 ttm -65.99 -31.01 71.67 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.8 m -71.74 -34.98 69.99 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.048 -1.033 . . . . 0.0 112.533 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -70.5 -33.34 71.1 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.086 -1.009 . . . . 0.0 112.346 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.75 -27.35 66.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.494 0.718 . . . . 0.0 112.189 168.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.01 -23.65 48.16 Favored Glycine 0 CA--C 1.538 1.525 0 O-C-N 120.302 -1.499 . . . . 0.0 114.778 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.84 -27.72 44.39 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.603 1.701 . . . . 0.0 112.511 166.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -64.33 -2.66 2.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 115.81 174.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -117.93 28.13 8.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.953 1.701 . . . . 0.0 112.121 -174.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.8 p -123.46 -9.77 7.98 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -161.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.5 p -76.28 32.7 0.12 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -147.42 144.78 28.9 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 127.856 2.462 . . . . 0.0 110.606 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.66 -21.53 64.49 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -61.72 -22.86 65.72 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.49 1.116 . . . . 0.0 113.128 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -129.37 22.03 5.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.678 1.591 . . . . 0.0 113.045 -171.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.28 -27.3 38.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 O-C-N 120.568 -1.332 . . . . 0.0 112.704 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.13 -29.4 34.79 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.842 -1.161 . . . . 0.0 112.014 172.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.0 mm -65.68 -32.63 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.932 1.293 . . . . 0.0 110.945 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -63.15 -37.97 89.31 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.179 -0.95 . . . . 0.0 112.975 177.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.7 m -67.66 -46.01 73.62 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.667 0.787 . . . . 0.0 112.286 166.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.69 -56.12 13.4 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.597 1.159 . . . . 0.0 111.704 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.4 -31.12 68.21 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.598 1.09 . . . . 0.0 113.462 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -71.1 -40.84 71.27 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.748 1.158 . . . . 0.0 112.433 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.28 67.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.38 0.991 . . . . 0.0 111.931 173.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.349 1.431 . . . . 0.0 112.217 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.5 tp -64.94 -37.86 89.06 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.776 0.83 . . . . 0.0 112.229 176.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.47 -46.89 58.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 15.8 tp -73.02 -19.52 61.18 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.619 -1.3 . . . . 0.0 112.596 -177.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.36 87.35 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 120.27 1.395 . . . . 0.0 112.489 168.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . 0.328 0.9 OUTLIER -78.79 -9.75 59.55 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 169.725 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -82.74 -43.76 7.58 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.23 1.395 . . . . 0.0 114.106 166.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.36 -28.99 65.55 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.075 1.75 . . . . 0.0 113.253 -177.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 172.773 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -15.74 57.2 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 175.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' HE2' ' HZ1' ' A' ' 8' ' ' LYS . 69.1 mm-40 -77.01 -48.33 18.23 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.894 -1.128 . . . . 0.0 111.355 166.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -35.6 81.02 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.547 -1.346 . . . . 0.0 112.527 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.41 -21.92 62.79 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HZ1' ' HE2' ' A' ' 5' ' ' GLU . 9.8 ptpp? -84.55 -38.04 20.48 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.782 1.174 . . . . 0.0 112.253 171.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.86 -32.34 73.82 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 111.736 176.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -56.49 -42.55 78.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.576 1.15 . . . . 0.0 112.107 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.69 -43.09 96.53 Favored Glycine 0 CA--C 1.533 1.216 0 O-C-N 121.587 -0.696 . . . . 0.0 113.252 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -64.5 -37.77 88.68 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.604 -0.939 . . . . 0.0 112.049 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.3 t -66.76 -45.56 78.18 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.654 -0.654 . . . . 0.0 111.877 173.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.33 -36.67 73.75 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 112.575 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.8 -40.73 80.6 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 170.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -38.76 91.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.938 0.895 . . . . 0.0 112.78 175.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 4.24 10.84 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 173.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.16 4.38 90.24 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 121.069 -1.019 . . . . 0.0 114.274 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.7 mt -88.95 55.44 3.35 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.863 1.665 . . . . 0.0 110.674 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -57.05 -39.68 75.33 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.958 0.903 . . . . 0.0 111.837 -175.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.94 -38.21 69.86 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.53 -0.731 . . . . 0.0 111.553 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.53 -40.3 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.252 1.021 . . . . 0.0 111.763 171.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.49 84.11 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.351 -0.843 . . . . 0.0 112.034 175.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -59.37 -35.9 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.743 1.217 . . . . 0.0 111.063 172.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -63.22 -45.55 91.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.438 1.095 . . . . 0.0 111.577 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.15 -43.94 93.65 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.54 1.136 . . . . 0.0 112.011 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -65.86 -35.21 80.03 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 0.0 112.396 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -67.94 -25.69 65.59 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.536 -0.728 . . . . 0.0 112.613 173.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.9 mm-40 -66.26 -34.7 78.6 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.283 1.401 . . . . 0.0 111.813 171.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.12 -48.11 83.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 118.689 0.677 . . . . 0.0 110.609 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.8 mt -72.03 -41.41 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.503 1.121 . . . . 0.0 110.212 -177.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.6 m -57.62 -37.93 74.1 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.768 0.827 . . . . 0.0 111.626 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.42 -29.25 47.03 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -136.08 62.16 44.15 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.625 1.57 . . . . 0.0 112.374 -168.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -64.42 -23.85 64.66 Favored 'Trans proline' 0 C--N 1.352 0.725 0 N-CA-C 117.516 2.083 . . . . 0.0 117.516 -161.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -104.01 4.85 34.93 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.267 1.027 . . . . 0.0 113.097 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -84.74 116.25 64.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 120.941 -1.1 . . . . 0.0 110.842 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.462 ' HA ' ' CD2' ' A' ' 41' ' ' TYR . 71.6 Cg_endo -64.19 -13.06 35.7 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.498 2.132 . . . . 0.0 114.223 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -52.24 -42.49 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 124.353 1.061 . . . . 0.0 112.228 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.01 -39.83 62.97 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.683 -0.509 . . . . 0.0 112.272 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 38' ' ' PRO . 2.7 m-30 -59.62 -38.99 82.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 117.576 0.688 . . . . 0.0 110.46 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.4 p -63.89 -35.93 82.27 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -79.43 -29.85 42.05 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.55 -0.718 . . . . 0.0 112.528 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -69.76 -33.17 72.05 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.417 1.008 . . . . 0.0 112.084 168.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.49 91.29 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.714 -1.241 . . . . 0.0 112.36 167.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.6 ttt -60.98 -37.81 83.74 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.641 -0.662 . . . . 0.0 111.865 170.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.58 -46.59 88.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.885 0.766 . . . . 0.0 111.761 173.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.1 mt -63.18 -37.4 87.07 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.554 -0.716 . . . . 0.0 112.678 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 26.6 pt -76.36 -7.64 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 172.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.37 -18.24 14.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.62 1.568 . . . . 0.0 113.207 176.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 tt -86.25 -34.64 20.35 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.563 1.945 . . . . 0.0 110.484 166.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.28 20.11 9.43 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.809 1.195 . . . . 0.0 114.961 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -96.35 53.61 1.33 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.015 1.726 . . . . 0.0 109.828 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -57.05 -34.58 68.39 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.778 1.231 . . . . 0.0 113.273 -169.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -66.63 -23.79 66.21 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.654 1.182 . . . . 0.0 112.299 176.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -85.63 -34.93 21.25 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.408 -0.807 . . . . 0.0 111.102 168.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.37 97.21 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.378 -0.826 . . . . 0.0 112.479 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.3 pt -59.78 -40.4 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.654 0.661 . . . . 0.0 111.799 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -64.73 -44.93 88.58 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.99 1.316 . . . . 0.0 111.238 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.2 ttm -68.24 -32.67 73.02 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.452 -0.78 . . . . 0.0 112.776 177.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.7 m -69.55 -42.62 74.34 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 120.802 -1.186 . . . . 0.0 111.853 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -60.72 -41.36 95.13 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.441 0.696 . . . . 0.0 111.357 172.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.95 -29.32 69.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 171.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.28 -28.25 45.29 Favored Glycine 0 N--CA 1.474 1.178 0 CA-C-N 120.768 1.622 . . . . 0.0 114.524 174.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.09 -20.76 65.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 119.887 1.844 . . . . 0.0 112.81 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -57.44 -11.98 2.29 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.51 1.524 . . . . 0.0 114.687 165.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -116.09 32.22 6.24 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 126.998 2.119 . . . . 0.0 112.242 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.6 p -136.99 8.48 2.99 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -167.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.2 m -78.62 2.89 17.85 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.4 t -144.27 156.08 44.12 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.891 -1.131 . . . . 0.0 113.177 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.12 -28.0 16.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.171 2.188 . . . . 0.0 116.734 -166.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -75.45 -0.0 18.57 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -132.27 16.91 4.52 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.974 1.71 . . . . 0.0 113.545 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.58 -27.73 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 119.534 -1.979 . . . . 0.0 113.338 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.85 74.2 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.655 -0.653 . . . . 0.0 111.193 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.29 -34.42 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.08 0.952 . . . . 0.0 111.033 174.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -52.51 -59.61 4.23 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.084 0.856 . . . . 0.0 109.901 171.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.7 m -61.64 -39.59 91.86 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.902 1.281 . . . . 0.0 113.115 176.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -79.44 4.4 15.64 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -110.65 -29.29 8.08 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 117.177 -1.392 . . . . 0.0 113.287 152.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -53.86 -57.72 9.91 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 121.315 1.871 . . . . 0.0 111.203 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -31.92 73.01 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.786 -0.571 . . . . 0.0 111.457 -172.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -62.98 -43.57 98.42 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.823 0.849 . . . . 0.0 111.152 174.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -66.92 -42.62 85.07 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.649 1.179 . . . . 0.0 111.194 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.3 -33.98 74.46 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.735 1.214 . . . . 0.0 113.095 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 18.8 mt -93.56 -12.29 29.87 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -46.21 78.41 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.932 1.696 . . . . 0.0 110.298 164.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -74.09 -16.24 61.03 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -76.06 -47.73 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.034 1.778 . . . . 0.0 113.579 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.19 -31.58 66.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.869 1.667 . . . . 0.0 112.816 -176.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.61 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 111.372 0.138 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -15.13 61.88 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.638 -1.289 . . . . 0.0 113.788 176.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.86 -46.67 14.91 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.927 0.891 . . . . 0.0 110.666 165.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -37.3 83.34 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.418 -1.426 . . . . 0.0 112.676 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -73.65 -24.26 59.98 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.918 0.887 . . . . 0.0 113.13 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -83.89 -31.81 25.5 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.15 0.886 . . . . 0.0 113.191 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.46 -45.38 69.19 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.928 0.785 . . . . 0.0 111.183 169.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -50.97 -48.15 61.21 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.841 1.256 . . . . 0.0 110.537 168.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.54 50.32 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 117.805 -1.553 . . . . 0.0 114.792 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -90.23 -41.91 11.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 121.061 2.431 . . . . 0.0 111.575 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.4 t -57.43 -36.83 71.88 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.549 -0.719 . . . . 0.0 112.338 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.2 mt -62.54 -39.64 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.96 -1.088 . . . . 0.0 112.207 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.99 -40.3 96.06 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.876 1.216 . . . . 0.0 112.585 169.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.71 -42.5 83.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.348 0.522 . . . . 0.0 112.223 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -74.7 -36.37 62.72 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.267 1.427 . . . . 0.0 113.278 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.36 10.4 8.0 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.382 1.467 . . . . 0.0 115.577 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -89.89 58.63 4.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.312 2.245 . . . . 0.0 109.64 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -60.07 -37.02 78.66 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.709 1.204 . . . . 0.0 113.595 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.5 mmt-85 -73.65 -42.37 61.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.73 0.695 . . . . 0.0 110.624 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -65.15 -30.04 70.93 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.3 14.09 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.49 0.716 . . . . 0.0 111.308 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.81 -35.31 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.989 1.315 . . . . 0.0 111.907 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -54.62 -45.79 73.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.724 0.809 . . . . 0.0 112.397 170.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.4 m -63.99 -38.92 92.85 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.167 0.894 . . . . 0.0 112.21 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -67.42 -35.83 80.05 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -65.11 -29.05 69.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 118.689 0.677 . . . . 0.0 111.908 174.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -72.3 -26.36 61.94 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.509 1.049 . . . . 0.0 112.764 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.0 mt -62.69 -49.31 75.6 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.204 0.601 . . . . 0.0 110.593 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.3 mt -80.93 -27.6 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.694 1.198 . . . . 0.0 111.195 -173.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.4 m -62.25 -27.89 69.32 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.383 -1.448 . . . . 0.0 112.194 168.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.78 -27.29 16.56 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 171.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -135.83 76.11 54.03 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.067 1.747 . . . . 0.0 110.426 -171.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -61.73 -25.0 78.27 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.938 3.092 . . . . 0.0 118.203 -166.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -116.46 -22.26 8.83 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.673 1.189 . . . . 0.0 112.502 -175.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.02 122.75 65.22 Favored Pre-proline 0 CA--C 1.545 0.777 0 O-C-N 121.657 -0.652 . . . . 0.0 112.57 -168.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.74 -20.4 51.13 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.112 2.541 . . . . 0.0 113.963 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.32 -32.65 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 119.114 0.87 . . . . 0.0 113.291 170.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.14 -40.89 15.05 Favored Glycine 0 C--N 1.34 0.778 0 O-C-N 121.409 -0.807 . . . . 0.0 111.846 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -70.93 -32.67 69.65 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -174.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.0 p -68.41 -41.12 80.88 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.722 1.601 . . . . 0.0 111.753 172.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -70.69 -36.44 73.3 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.832 0.853 . . . . 0.0 111.817 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -74.27 -29.5 61.69 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.565 -1.334 . . . . 0.0 112.115 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.04 -33.08 73.9 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.699 -1.251 . . . . 0.0 112.316 165.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -65.72 -40.58 92.37 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.333 -0.855 . . . . 0.0 111.189 171.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.96 86.79 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.586 -0.696 . . . . 0.0 112.516 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.63 -40.47 87.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.488 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 31.4 pt -76.38 -25.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 120.632 1.56 . . . . 0.0 113.452 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.17 -15.88 59.34 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 119.496 1.044 . . . . 0.0 113.268 172.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -92.28 -34.05 14.39 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.791 1.636 . . . . 0.0 111.734 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.16 25.1 5.18 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.557 2.027 . . . . 0.0 115.982 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -99.0 56.6 1.05 Allowed 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 118.941 1.371 . . . . 0.0 111.938 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -57.44 -30.45 65.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.028 1.331 . . . . 0.0 113.663 -173.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.4 m -72.42 -30.73 64.88 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.178 0.899 . . . . 0.0 112.491 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -78.46 -30.72 47.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.144 0.884 . . . . 0.0 111.281 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.67 -40.84 92.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.98 0.912 . . . . 0.0 112.516 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.9 pt -70.67 -25.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.6 tm0? -72.41 -44.15 62.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.677 0.672 . . . . 0.0 111.165 166.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.4 ttm -58.61 -31.83 68.45 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.78 0.718 . . . . 0.0 112.19 174.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 94.0 m -60.9 -46.89 88.84 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.512 -0.743 . . . . 0.0 112.572 171.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -68.87 -35.98 77.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.254 1.021 . . . . 0.0 112.209 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -27.22 69.01 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.764 0.826 . . . . 0.0 112.454 168.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.4 -27.15 52.85 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.285 -1.51 . . . . 0.0 114.139 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.07 -12.49 55.79 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.096 1.448 . . . . 0.0 112.863 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -71.37 -5.55 33.47 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.22 1.408 . . . . 0.0 114.716 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.54 29.46 5.74 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.467 1.507 . . . . 0.0 113.659 -167.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 70.3 p -117.77 -5.14 11.11 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 -161.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.89 30.57 0.5 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -155.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.8 p -144.32 163.85 32.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.009 1.324 . . . . 0.0 111.828 -176.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.15 -28.12 69.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.099 0.96 . . . . 0.0 113.192 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.16 -19.69 64.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.006 0.922 . . . . 0.0 112.809 172.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -127.66 12.51 6.87 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -171.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 p -64.62 -32.92 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 120.837 -1.164 . . . . 0.0 113.225 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.3 -37.32 52.94 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.273 -0.892 . . . . 0.0 110.645 170.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.17 -37.78 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.905 0.882 . . . . 0.0 112.681 171.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ttp85 -59.16 -40.99 87.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.91 0.884 . . . . 0.0 111.281 176.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.1 m -70.62 -39.44 73.72 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.966 0.906 . . . . 0.0 112.84 167.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -61.96 -29.65 70.39 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.202 1.365 . . . . 0.0 112.715 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.7 -38.28 19.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.717 1.144 . . . . 0.0 113.498 169.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -66.89 -40.75 87.86 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 120.362 1.437 . . . . 0.0 113.706 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -36.81 73.67 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.498 0.59 . . . . 0.0 111.05 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -61.84 -36.14 80.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.881 0.872 . . . . 0.0 111.674 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.9 tt -67.4 -51.21 54.56 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.372 1.469 . . . . 0.0 110.6 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.07 -36.14 74.56 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.506 1.122 . . . . 0.0 112.562 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.48 -7.06 59.4 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 173.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.31 39.19 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 120.876 1.671 . . . . 0.0 109.179 164.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -63.51 -29.0 70.34 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.713 . . . . 0.0 111.388 169.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.41 -43.87 60.59 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 125.784 1.659 . . . . 0.0 113.707 172.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -76.11 -23.07 54.9 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 123.431 0.692 . . . . 0.0 112.839 167.994 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.293 0.0 OUTLIER -71.22 -26.9 63.13 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.525 -1.36 . . . . 0.0 111.782 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -70.77 -13.73 62.16 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.04 -35.61 10.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.488 1.04 . . . . 0.0 112.878 166.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -70.77 -36.73 73.2 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.264 0.938 . . . . 0.0 113.116 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.66 -21.54 66.44 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.909 -1.12 . . . . 0.0 112.804 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -90.52 -34.74 15.43 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.089 1.356 . . . . 0.0 112.481 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -56.08 -41.15 74.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.845 1.258 . . . . 0.0 111.811 174.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.14 -42.3 71.83 Favored Glycine 0 CA--C 1.54 1.608 0 O-C-N 121.442 -0.786 . . . . 0.0 113.546 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -68.57 -40.22 80.66 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.952 1.376 . . . . 0.0 111.289 175.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.6 m -58.74 -36.55 74.49 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.425 -0.797 . . . . 0.0 112.714 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.35 -34.04 76.48 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.88 -1.138 . . . . 0.0 111.809 173.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -70.49 -26.64 63.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -51.12 60.71 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.368 1.44 . . . . 0.0 110.343 166.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -66.55 -33.64 76.12 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -175.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.32 -0.4 8.83 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.956 1.142 . . . . 0.0 115.956 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.2 mt -89.54 53.16 2.52 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.233 2.213 . . . . 0.0 111.342 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -56.08 -36.89 68.63 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.892 1.677 . . . . 0.0 112.971 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -83.27 -28.52 29.08 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.03 -1.044 . . . . 0.0 112.982 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -73.43 -29.0 62.28 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 118.722 0.692 . . . . 0.0 112.118 166.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.21 69.05 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 172.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.6 t -60.24 -37.19 72.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 O-C-N 121.15 -0.969 . . . . 0.0 111.065 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -62.57 -45.75 91.48 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.66 -0.686 . . . . 0.0 112.237 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.5 t -55.19 -47.92 74.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.366 1.067 . . . . 0.0 111.481 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -68.67 -29.95 68.53 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -68.72 -23.47 64.36 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.224 -0.923 . . . . 0.0 112.78 168.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -69.63 -34.84 74.62 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.755 1.161 . . . . 0.0 111.242 172.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.47 -48.55 77.21 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.901 0.773 . . . . 0.0 109.915 174.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.8 mt -63.14 -37.95 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.952 0.501 . . . . 0.0 110.789 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.6 m -58.46 -39.5 80.09 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.47 -0.769 . . . . 0.0 112.027 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.25 -31.0 43.4 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.43 74.49 20.05 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 124.572 1.149 . . . . 0.0 112.859 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -63.35 -28.56 71.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.641 2.894 . . . . 0.0 117.436 -168.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -105.62 4.84 30.67 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.027 1.331 . . . . 0.0 112.957 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.51 120.55 73.18 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.342 -0.849 . . . . 0.0 110.103 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -61.93 -14.59 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 122.318 2.012 . . . . 0.0 114.226 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.4 p -47.14 -50.56 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.155 0.982 . . . . 0.0 111.416 167.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.11 -43.45 93.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 123.924 0.773 . . . . 0.0 112.5 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -63.53 -40.83 98.05 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.356 0.662 . . . . 0.0 112.169 173.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.0 p -67.43 -35.29 78.95 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.34 -0.85 . . . . 0.0 112.761 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -72.25 -38.51 68.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.144 0.978 . . . . 0.0 112.352 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -71.18 -32.26 68.65 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.411 1.005 . . . . 0.0 112.479 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.38 -42.09 96.35 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.114 -0.991 . . . . 0.0 112.322 168.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.0 -42.59 94.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.845 0.858 . . . . 0.0 111.511 171.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.97 90.78 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.706 0.802 . . . . 0.0 112.414 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 48.9 mt -64.51 -34.92 79.35 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.61 -0.681 . . . . 0.0 112.812 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.8 pt -73.62 -35.78 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.73 1.15 . . . . 0.0 112.892 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -12.83 61.36 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.44 1.096 . . . . 0.0 113.159 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.8 tt -93.44 -41.19 9.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.566 1.947 . . . . 0.0 111.528 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 110.63 21.85 6.63 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 124.772 1.177 . . . . 0.0 115.064 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -100.87 51.48 0.86 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.564 1.546 . . . . 0.0 109.67 171.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -51.02 -41.7 59.98 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.6 1.96 . . . . 0.0 112.624 -176.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.1 m -63.72 -25.95 68.43 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 113.158 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -81.19 -35.9 30.8 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.179 -0.951 . . . . 0.0 111.233 171.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -39.41 91.77 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.803 0.841 . . . . 0.0 112.195 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.3 pt -64.32 -34.76 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.762 0.71 . . . . 0.0 112.474 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.5 tm0? -64.47 -47.91 77.22 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.811 0.732 . . . . 0.0 110.551 171.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.5 ttm -63.18 -31.34 72.46 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 178.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.8 m -66.83 -46.18 75.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.971 -1.08 . . . . 0.0 112.362 173.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -72.41 -32.7 66.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.622 0.769 . . . . 0.0 111.867 -178.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -39.0 92.87 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.953 1.301 . . . . 0.0 112.382 164.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.18 -28.19 73.02 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 120.196 -1.565 . . . . 0.0 113.969 177.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.71 -23.1 67.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.454 1.127 . . . . 0.0 112.857 168.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -74.2 -0.18 15.99 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 169.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.22 20.71 15.98 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.597 1.559 . . . . 0.0 113.103 175.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -139.11 126.72 21.84 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.355 -1.466 . . . . 0.0 114.036 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -148.67 -36.02 0.19 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.073 1.749 . . . . 0.0 112.429 167.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.9 p -76.65 167.37 21.96 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.317 1.447 . . . . 0.0 113.622 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.86 -21.03 66.03 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.9 -1.125 . . . . 0.0 113.148 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.37 -28.45 66.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.401 1.08 . . . . 0.0 112.756 170.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -120.87 15.72 11.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.228 1.411 . . . . 0.0 112.369 -169.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.79 -37.24 61.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.247 -0.908 . . . . 0.0 112.259 -178.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.51 -36.41 63.2 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.688 -0.633 . . . . 0.0 110.623 172.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.8 mm -53.08 -39.98 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.397 1.079 . . . . 0.0 112.447 168.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -34.3 76.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.246 1.019 . . . . 0.0 112.257 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.9 m -80.21 -33.33 38.21 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.112 0.965 . . . . 0.0 113.489 166.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -71.94 -3.07 20.51 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.341 1.456 . . . . 0.0 114.382 176.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -96.84 -47.64 5.77 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.182 0.901 . . . . 0.0 112.205 153.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.13 -32.09 69.93 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -171.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.43 -37.99 74.49 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.177 1.353 . . . . 0.0 111.019 173.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.358 4.5 ptp180 -80.41 -12.86 59.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.84 -44.14 67.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.452 1.101 . . . . 0.0 111.168 157.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -35.98 78.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.981 1.312 . . . . 0.0 112.815 171.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.93 -23.83 28.66 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.89 1.276 . . . . 0.0 113.826 176.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.7 75.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.349 1.431 . . . . 0.0 109.715 168.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -59.45 -26.31 65.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.733 1.213 . . . . 0.0 112.01 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.38 -58.7 7.55 Favored Glycine 0 N--CA 1.467 0.732 0 C-N-CA 127.351 2.405 . . . . 0.0 113.622 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.71 -31.73 68.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.1 0.96 . . . . 0.0 112.471 -174.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 176.573 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -24.42 60.98 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.805 -1.185 . . . . 0.0 113.118 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.98 -24.31 30.66 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.998 0.919 . . . . 0.0 111.841 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.2 tttt -70.05 -51.2 33.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.081 1.752 . . . . 0.0 111.674 162.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -25.19 66.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -166.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.72 -40.0 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 172.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -71.19 -30.3 66.23 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.394 0.678 . . . . 0.0 111.655 175.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -68.1 -43.58 78.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.494 1.518 . . . . 0.0 111.05 170.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.36 -53.42 43.28 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.269 0.938 . . . . 0.0 112.679 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -56.37 -48.8 76.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.714 1.257 . . . . 0.0 111.659 174.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.7 t -55.92 -47.45 77.49 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.768 0.827 . . . . 0.0 113.153 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.4 mt -61.28 -28.56 69.27 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.278 -0.889 . . . . 0.0 112.815 -177.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -67.93 -37.49 81.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.282 0.946 . . . . 0.0 113.21 170.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -36.41 81.1 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 119.906 1.23 . . . . 0.0 112.648 172.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -74.5 -6.18 46.94 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 171.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.83 11.5 84.56 Favored Glycine 0 CA--C 1.537 1.462 0 O-C-N 120.37 -1.456 . . . . 0.0 114.992 -178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 48.5 mt -87.32 54.33 3.11 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.844 2.058 . . . . 0.0 110.613 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -55.88 -36.19 67.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.359 1.063 . . . . 0.0 112.638 -170.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -80.56 -18.47 48.25 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.775 1.23 . . . . 0.0 113.01 -176.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.01 -36.41 17.04 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.063 0.545 . . . . 0.0 111.442 165.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.751 1.22 . . . . 0.0 112.733 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.51 -36.72 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.794 0.838 . . . . 0.0 110.389 172.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -64.85 -43.14 93.99 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.441 1.018 . . . . 0.0 112.872 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.67 -39.39 91.24 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.821 0.737 . . . . 0.0 112.263 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -75.31 -35.53 61.23 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 175.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -62.38 -36.02 81.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.336 0.971 . . . . 0.0 111.414 171.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -74.71 -15.9 60.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 113.271 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.65 -47.37 84.68 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.304 0.956 . . . . 0.0 110.682 160.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.1 mt -81.79 -25.94 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.337 1.055 . . . . 0.0 112.053 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 m -62.9 -33.15 74.71 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.572 -1.33 . . . . 0.0 111.183 169.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.83 -37.07 18.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.607 1.163 . . . . 0.0 113.404 174.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -129.86 74.14 80.87 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 125.86 1.664 . . . . 0.0 110.603 -169.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -63.13 -19.44 68.8 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.723 2.949 . . . . 0.0 117.537 -167.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -124.3 -10.73 7.5 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.443 1.097 . . . . 0.0 113.107 -171.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -70.13 122.87 87.56 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 124.014 0.926 . . . . 0.0 111.258 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -67.95 -9.23 24.99 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.999 1.8 . . . . 0.0 113.999 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -46.38 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.605 1.093 . . . . 0.0 110.989 163.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.52 -39.88 95.84 Favored Glycine 0 CA--C 1.527 0.802 0 O-C-N 121.266 -0.896 . . . . 0.0 112.03 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -65.36 -38.86 91.35 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 117.77 0.785 . . . . 0.0 112.128 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 m -62.44 -38.28 89.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.211 1.005 . . . . 0.0 112.041 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -75.14 -40.78 59.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.534 1.133 . . . . 0.0 112.224 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -65.12 -31.79 73.16 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 120.292 -1.505 . . . . 0.0 112.244 173.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.31 -36.53 83.98 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.259 -0.9 . . . . 0.0 112.561 169.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.4 tpp -63.58 -44.11 95.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.099 0.863 . . . . 0.0 111.276 171.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.09 -48.29 78.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.264 0.626 . . . . 0.0 112.08 175.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.59 -39.2 93.3 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.537 -0.727 . . . . 0.0 112.445 -177.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.52 -7.69 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 CA-C-N 120.07 1.305 . . . . 0.0 114.134 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.36 -20.1 14.72 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.053 1.341 . . . . 0.0 113.555 176.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.24 -9.7 49.73 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.411 2.284 . . . . 0.0 111.422 166.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.67 21.48 63.85 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.915 1.245 . . . . 0.0 114.866 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -92.59 51.2 1.7 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.561 1.944 . . . . 0.0 109.402 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -58.15 -37.17 74.14 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.081 -1.012 . . . . 0.0 112.445 -170.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.7 m -52.7 -31.81 39.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.899 1.28 . . . . 0.0 113.484 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -95.84 -27.09 15.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.353 1.461 . . . . 0.0 110.858 -177.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.21 -41.98 80.52 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.933 0.893 . . . . 0.0 112.078 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.5 pt -65.43 -35.01 74.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 118.999 0.818 . . . . 0.0 111.588 177.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -63.26 -45.54 91.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.013 0.925 . . . . 0.0 111.337 170.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 35.2 tpp -60.46 -43.76 96.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.955 0.798 . . . . 0.0 112.299 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.91 -46.61 84.04 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.128 -0.982 . . . . 0.0 112.246 177.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.75 -36.47 83.16 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.857 0.863 . . . . 0.0 112.181 174.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -38.48 84.73 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.176 0.99 . . . . 0.0 111.788 172.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.94 -34.17 65.44 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 120.269 -1.519 . . . . 0.0 113.598 178.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.78 -6.53 27.23 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 118.524 1.162 . . . . 0.0 113.401 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -76.48 -22.56 54.38 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 162.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -92.55 -7.31 47.57 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.862 1.265 . . . . 0.0 114.31 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.0 p -86.54 -1.13 57.37 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 -160.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 m -86.71 42.2 1.0 Allowed 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 120.206 1.366 . . . . 0.0 114.236 -169.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 p -138.62 159.65 41.57 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.198 1.399 . . . . 0.0 111.544 169.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.76 -6.97 17.99 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -87.18 -14.98 39.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.678 1.591 . . . . 0.0 112.259 171.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -126.36 14.51 7.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.455 1.502 . . . . 0.0 114.014 -173.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.19 -14.93 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 120.549 -1.344 . . . . 0.0 114.219 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.95 -39.19 15.95 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.914 -1.116 . . . . 0.0 111.267 164.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.6 mm -53.06 -36.48 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.132 0.973 . . . . 0.0 111.371 170.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.3 ttp180 -55.36 -39.5 70.14 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.831 1.252 . . . . 0.0 113.269 175.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.2 m -78.06 -37.9 45.65 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.036 1.335 . . . . 0.0 112.856 170.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.6 mttm -55.37 -51.72 65.88 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.943 1.247 . . . . 0.0 111.381 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.92 -31.19 64.47 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.092 1.315 . . . . 0.0 113.456 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -77.34 -30.72 54.09 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 120.971 1.714 . . . . 0.0 114.568 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -42.2 59.64 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.29 1.405 . . . . 0.0 110.655 166.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -62.16 -32.57 73.21 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.172 0.896 . . . . 0.0 111.688 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.5 tp -67.76 -44.28 77.87 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.756 1.222 . . . . 0.0 112.815 171.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -68.96 -32.46 72.06 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.282 -0.886 . . . . 0.0 113.352 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.6 tp -83.2 -22.12 33.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.46 -0.781 . . . . 0.0 112.678 174.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.92 92.39 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.522 1.51 . . . . 0.0 111.089 164.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -63.58 -30.04 71.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.033 0.933 . . . . 0.0 111.989 172.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.32 -49.57 44.68 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 125.697 1.617 . . . . 0.0 112.538 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.63 -37.55 70.86 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.738 1.215 . . . . 0.0 112.162 -177.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 N--CA 1.479 1.011 0 O-C-N 121.42 -0.8 . . . . 0.0 111.655 174.628 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -35.07 78.6 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.546 1.138 . . . . 0.0 112.332 170.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.257 0.2 OUTLIER -90.35 -14.43 33.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.92 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -27.97 32.94 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.667 1.187 . . . . 0.0 112.495 164.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -62.83 -50.68 70.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.958 1.303 . . . . 0.0 113.072 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -59.54 -30.48 68.63 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -49.59 49.5 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.727 -0.608 . . . . 0.0 110.912 171.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -58.72 -37.11 75.44 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.764 0.826 . . . . 0.0 111.56 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.89 -15.01 54.77 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.885 1.231 . . . . 0.0 115.176 174.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -94.84 -45.82 7.14 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.63 1.715 . . . . 0.0 110.754 168.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.3 m -53.41 -44.61 68.86 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.62 0.768 . . . . 0.0 112.755 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 mt -58.91 -38.11 78.18 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.246 1.018 . . . . 0.0 112.825 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -61.5 -38.16 86.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.283 -0.886 . . . . 0.0 112.05 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -71.17 -10.32 59.56 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -102.48 -0.79 31.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.018 1.327 . . . . 0.0 113.868 165.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.22 5.34 82.95 Favored Glycine 0 CA--C 1.536 1.365 0 O-C-N 121.116 -0.99 . . . . 0.0 115.001 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 98.3 mt -83.73 52.74 2.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.746 1.618 . . . . 0.0 110.952 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -56.87 -40.43 76.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.926 1.29 . . . . 0.0 111.924 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -72.96 -39.25 66.34 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.728 -0.653 . . . . 0.0 111.608 -178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -70.26 -32.65 70.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.445 1.02 . . . . 0.0 111.373 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.95 -44.3 89.87 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.015 -1.053 . . . . 0.0 112.183 173.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.97 -42.16 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.656 0.783 . . . . 0.0 110.924 171.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -58.53 -45.55 88.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.05 0.841 . . . . 0.0 112.516 174.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.2 m -62.72 -41.84 99.36 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.538 1.135 . . . . 0.0 112.5 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -67.48 -36.35 80.95 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.462 -0.774 . . . . 0.0 112.244 172.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.37 -28.52 69.75 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.722 0.692 . . . . 0.0 112.576 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -68.99 -28.81 66.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.89 -1.131 . . . . 0.0 112.229 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -63.5 -48.09 79.02 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.772 0.715 . . . . 0.0 110.373 169.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.6 mt -72.11 -24.72 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 C-N-CA 124.845 1.258 . . . . 0.0 111.241 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 94.5 m -68.32 -31.28 70.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.754 1.222 . . . . 0.0 111.455 172.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -85.41 -32.84 22.14 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.985 0.811 . . . . 0.0 112.803 169.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -132.21 77.71 70.29 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.18 1.392 . . . . 0.0 112.672 -169.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -65.98 -18.32 56.91 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 121.87 1.713 . . . . 0.0 115.088 175.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -113.3 -26.72 8.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.042 1.337 . . . . 0.0 112.896 -170.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -70.46 127.44 92.06 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.193 1.361 . . . . 0.0 111.486 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -67.9 -7.63 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.725 2.284 . . . . 0.0 115.277 -176.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 p -55.48 -39.61 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.808 1.243 . . . . 0.0 111.687 171.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.9 -45.56 32.85 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.365 -0.834 . . . . 0.0 112.115 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -64.75 -40.38 95.21 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.744 -0.857 . . . . 0.0 112.388 177.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 72.1 p -69.89 -18.52 63.41 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -83.9 -40.42 18.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 112.078 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.51 -37.69 73.4 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.64 -1.287 . . . . 0.0 112.018 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.98 -29.6 70.94 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 171.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.45 -42.68 87.28 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.042 0.837 . . . . 0.0 111.059 173.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.8 -46.42 87.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.966 0.506 . . . . 0.0 111.602 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 99.3 mt -59.27 -42.31 90.9 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.873 -0.517 . . . . 0.0 112.367 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.6 pt -73.73 -29.46 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.131 0.878 . . . . 0.0 113.339 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.56 -14.16 57.18 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.962 1.256 . . . . 0.0 114.095 175.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.5 tt -87.95 -23.16 23.95 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.39 1.876 . . . . 0.0 111.497 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.75 21.67 33.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.44 1.019 . . . . 0.0 114.463 -177.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -100.58 53.19 0.87 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.039 1.4 . . . . 0.0 110.734 173.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -52.36 -37.92 57.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.774 1.63 . . . . 0.0 112.378 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m -68.59 -15.44 63.53 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.042 1.737 . . . . 0.0 113.376 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -90.53 -33.66 15.84 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.37 -0.831 . . . . 0.0 111.588 165.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.6 -35.15 79.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 113.13 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 pt -62.74 -36.39 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.229 0.922 . . . . 0.0 112.985 177.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -67.06 -41.98 85.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.211 0.605 . . . . 0.0 111.605 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 ttm -76.38 -29.52 57.17 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.79 -39.34 73.2 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.019 -1.051 . . . . 0.0 111.207 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -59.79 -44.03 94.14 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.107 0.867 . . . . 0.0 111.536 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.43 -35.29 71.88 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 175.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.41 -27.18 52.73 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-N 120.265 1.393 . . . . 0.0 114.415 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -59.7 -32.74 70.8 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.266 2.033 . . . . 0.0 112.171 172.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -60.9 -17.61 51.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -85.51 -1.22 56.85 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.595 1.158 . . . . 0.0 112.942 175.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.7 p -106.0 22.06 16.27 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -162.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m -66.18 -32.79 74.44 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 p -104.8 166.65 10.24 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -174.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.87 -23.29 67.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.62 -22.83 64.2 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.828 -1.17 . . . . 0.0 112.656 174.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -124.17 17.46 9.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.21 1.804 . . . . 0.0 112.273 -169.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.09 -27.5 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.567 -1.333 . . . . 0.0 112.919 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.97 63.81 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.284 -0.885 . . . . 0.0 111.038 171.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.8 mm -58.83 -30.72 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.165 0.986 . . . . 0.0 111.261 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -64.94 -38.26 90.39 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.939 -1.1 . . . . 0.0 113.013 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.5 t -68.37 -43.29 77.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.302 1.441 . . . . 0.0 111.529 167.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.3 tppt? -54.21 -53.44 53.53 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.94 0.896 . . . . 0.0 111.814 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -74.23 -31.1 62.46 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 120.098 1.317 . . . . 0.0 114.011 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -75.28 -36.03 61.24 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.743 1.611 . . . . 0.0 113.433 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 -38.58 82.24 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.805 1.639 . . . . 0.0 110.828 172.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -56.06 -37.44 69.28 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 119.494 1.043 . . . . 0.0 111.627 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.8 tp -72.78 -42.83 63.53 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.263 1.025 . . . . 0.0 112.904 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -67.38 -23.66 65.61 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 175.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -97.77 -20.16 17.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.035 1.334 . . . . 0.0 114.211 174.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.27 -49.42 77.92 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.61 1.55 . . . . 0.0 109.498 163.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -64.44 -26.97 68.68 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.427 1.091 . . . . 0.0 112.484 171.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -80.81 -33.94 28.91 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.45 1.024 . . . . 0.0 115.406 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -93.88 -26.01 17.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.014 1.326 . . . . 0.0 112.926 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.479 0.983 0 CA-C-N 119.259 0.936 . . . . 0.0 111.75 170.52 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.59 -17.9 55.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.596 -1.315 . . . . 0.0 113.18 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -74.16 -46.04 44.84 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.965 -1.084 . . . . 0.0 109.632 162.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -43.1 80.65 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.596 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.48 -24.38 61.17 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 120.223 1.374 . . . . 0.0 113.689 -178.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.264 10.9 ptpp? -77.85 -39.03 44.77 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 119.431 1.014 . . . . 0.0 112.71 169.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.14 -40.7 94.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.192 0.997 . . . . 0.0 112.277 170.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -60.85 -49.14 78.69 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.056 1.742 . . . . 0.0 111.34 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -39.36 97.14 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 119.409 1.004 . . . . 0.0 113.134 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -61.03 -42.3 98.22 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.626 1.713 . . . . 0.0 111.948 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.3 m -61.1 -44.4 97.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.218 1.007 . . . . 0.0 111.415 174.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.7 -38.92 92.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.747 1.219 . . . . 0.0 112.093 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -59.66 -35.68 74.9 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.599 1.091 . . . . 0.0 112.435 170.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -19.88 64.96 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 174.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -100.79 3.7 42.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.313 1.045 . . . . 0.0 113.239 170.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.92 13.47 83.36 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 121.122 -0.986 . . . . 0.0 114.768 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.6 mt -87.71 56.32 3.86 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.202 1.801 . . . . 0.0 110.344 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -57.33 -39.56 76.12 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.486 1.114 . . . . 0.0 113.246 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.02 -39.35 75.85 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.95 0.795 . . . . 0.0 110.751 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -64.63 -43.6 93.17 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.407 0.683 . . . . 0.0 111.045 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.31 76.81 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.876 0.871 . . . . 0.0 112.714 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.62 -38.48 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.013 0.925 . . . . 0.0 110.442 173.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -61.11 -42.99 99.55 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.089 0.859 . . . . 0.0 112.865 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.3 m -63.39 -35.13 79.37 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.764 0.826 . . . . 0.0 112.668 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -80.73 -34.15 34.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.28 1.032 . . . . 0.0 112.478 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -62.92 -34.61 77.8 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.211 0.914 . . . . 0.0 110.963 168.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -71.31 -17.65 62.44 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.5 mt -59.41 -46.48 88.58 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.678 1.126 . . . . 0.0 110.605 161.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.4 mt -77.24 -30.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.383 1.073 . . . . 0.0 111.206 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.1 m -62.64 -41.49 99.07 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.662 -1.274 . . . . 0.0 111.113 174.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.92 -30.26 61.2 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 174.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -137.78 62.02 32.45 Favored Pre-proline 0 CA--C 1.556 1.209 0 C-N-CA 124.542 1.137 . . . . 0.0 113.391 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -61.89 -27.97 80.68 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.549 2.166 . . . . 0.0 116.429 -165.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -103.03 -1.43 29.26 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.186 0.995 . . . . 0.0 113.082 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -84.33 123.9 74.43 Favored Pre-proline 0 CA--C 1.543 0.695 0 O-C-N 120.878 -1.139 . . . . 0.0 112.179 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -55.24 -23.81 38.87 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.478 . . . . 0.0 114.928 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.72 -38.95 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.471 1.032 . . . . 0.0 112.844 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.08 -46.31 59.14 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 119.305 0.957 . . . . 0.0 111.521 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -62.91 -40.46 97.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.47 1.108 . . . . 0.0 112.189 173.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.2 m -58.96 -34.5 71.85 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.241 1.016 . . . . 0.0 112.626 174.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.46 -44.19 17.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.794 0.838 . . . . 0.0 111.337 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -60.08 -34.7 73.81 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 121.087 1.767 . . . . 0.0 112.196 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.14 -34.18 77.06 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 168.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.1 tpt -66.11 -44.29 84.75 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.272 1.029 . . . . 0.0 111.727 172.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.62 -45.9 88.23 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.087 0.955 . . . . 0.0 112.065 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.55 -36.02 77.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 118.789 -0.624 . . . . 0.0 112.666 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.1 pt -84.08 -17.24 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 173.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -21.45 46.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.066 1.346 . . . . 0.0 112.049 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -88.2 -63.15 1.34 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.327 1.851 . . . . 0.0 109.542 172.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.66 15.77 0.73 Allowed Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.276 1.271 . . . . 0.0 116.276 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.06 59.71 1.98 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.304 1.552 . . . . 0.0 109.648 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.1 -30.33 68.02 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.602 1.161 . . . . 0.0 113.509 -173.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.7 m -70.11 -20.46 63.19 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.968 0.804 . . . . 0.0 112.176 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -79.09 -34.3 43.69 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.35 -1.469 . . . . 0.0 112.149 166.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.87 -45.5 64.3 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.8 pt -59.56 -40.49 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 CA-C-N 119.411 1.005 . . . . 0.0 111.857 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.0 tm0? -63.35 -49.08 75.31 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.461 1.104 . . . . 0.0 110.924 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.9 ttm -66.11 -28.14 68.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -64.69 -47.26 79.02 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.137 -0.977 . . . . 0.0 111.415 171.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -67.91 -36.09 79.59 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.932 0.493 . . . . 0.0 111.867 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -35.43 74.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.544 0.738 . . . . 0.0 112.565 166.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -73.13 -28.56 66.14 Favored Glycine 0 N--CA 1.471 1.006 0 CA-C-N 120.17 1.35 . . . . 0.0 114.433 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.06 -26.05 68.66 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.371 1.585 . . . . 0.0 112.688 175.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -59.23 -16.96 24.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.103 1.361 . . . . 0.0 114.447 172.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -95.92 13.7 25.97 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.189 1.795 . . . . 0.0 113.967 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.258 16.4 p -122.51 -126.06 0.26 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.51 1.124 . . . . 0.0 113.171 -164.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 74.5 m 56.32 27.33 11.74 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 126.983 2.113 . . . . 0.0 116.475 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.6 t -149.38 154.21 38.57 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.534 -1.354 . . . . 0.0 113.04 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.89 66.94 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 -167.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -77.54 -6.73 54.65 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -124.22 6.97 8.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.512 1.525 . . . . 0.0 113.356 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -64.61 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.357 -1.464 . . . . 0.0 113.553 -173.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.93 -42.23 66.9 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.304 -0.873 . . . . 0.0 111.308 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.24 -41.0 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.05 0.94 . . . . 0.0 111.804 170.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 69.0 ttt-85 -58.18 -47.54 83.11 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.141 0.576 . . . . 0.0 109.868 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.3 m -65.17 -32.3 73.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 117.424 -1.274 . . . . 0.0 113.895 175.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -55.19 -48.33 73.95 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.674 1.579 . . . . 0.0 110.997 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -75.5 -29.02 59.39 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -61.18 -50.48 72.96 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.556 1.525 . . . . 0.0 111.828 170.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -37.04 49.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.015 -0.517 . . . . 0.0 111.8 -174.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -59.48 -35.4 74.03 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.189 0.904 . . . . 0.0 111.588 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.03 -45.96 83.28 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.224 0.92 . . . . 0.0 112.102 172.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.53 -26.78 63.73 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.3 tt -89.61 -28.72 19.34 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.832 0.742 . . . . 0.0 112.622 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.22 -46.05 86.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.534 1.516 . . . . 0.0 111.727 173.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.57 -23.87 67.41 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.686 0.794 . . . . 0.0 112.814 171.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.85 -55.96 10.2 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.833 2.159 . . . . 0.0 114.29 170.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.62 -25.98 64.2 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.138 -1.213 . . . . 0.0 113.221 -176.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.483 1.222 0 O-C-N 121.212 -0.93 . . . . 0.0 113.219 168.677 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -38.87 10.08 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.705 1.138 . . . . 0.0 112.802 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -66.02 -16.12 63.63 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -33.15 22.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.901 0.881 . . . . 0.0 113.37 166.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -70.38 -36.56 74.18 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.324 -0.86 . . . . 0.0 112.189 -172.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -57.7 -41.04 80.89 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.438 1.095 . . . . 0.0 112.651 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -69.67 -34.52 74.1 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.043 0.537 . . . . 0.0 111.971 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -65.24 -34.4 78.27 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.259 1.024 . . . . 0.0 111.537 169.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.42 -49.19 58.19 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.294 1.426 . . . . 0.0 113.952 170.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -55.29 -34.63 64.29 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 118.632 1.216 . . . . 0.0 110.951 171.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.9 t -70.63 -40.62 72.99 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.46 1.104 . . . . 0.0 113.487 172.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.3 mt -57.34 -41.09 79.33 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.22 1.373 . . . . 0.0 111.314 174.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -58.46 -39.98 81.41 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.132 0.878 . . . . 0.0 111.703 170.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -31.3 72.46 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.719 1.208 . . . . 0.0 114.079 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.71 -8.01 59.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.738 1.215 . . . . 0.0 113.761 171.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.489 ' HA2' ' CE1' ' A' ' 20' ' ' TYR . . . 91.16 6.2 66.91 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.995 -1.066 . . . . 0.0 114.437 -173.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 47.2 mt -82.86 44.51 0.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.49 1.516 . . . . 0.0 110.615 -177.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.489 ' CE1' ' HA2' ' A' ' 18' ' ' GLY . 5.0 m-85 -55.76 -34.86 65.6 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 113.032 -168.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -76.84 -35.52 57.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 120.503 1.502 . . . . 0.0 112.116 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.13 -24.48 62.28 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.206 0.603 . . . . 0.0 112.268 168.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.92 -35.47 37.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.958 0.903 . . . . 0.0 113.105 174.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.97 -40.36 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 O-C-N 121.015 -1.053 . . . . 0.0 110.402 168.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.01 -35.84 64.81 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.122 0.569 . . . . 0.0 112.026 169.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 t -67.81 -50.86 54.54 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.726 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -34.98 76.01 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.536 1.062 . . . . 0.0 111.58 178.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -62.21 -29.77 70.61 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.611 0.764 . . . . 0.0 112.679 174.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -65.93 -39.78 90.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.245 1.384 . . . . 0.0 111.714 171.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.5 mt -64.54 -37.63 88.22 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.855 -0.528 . . . . 0.0 110.511 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -80.33 -20.72 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 C-N-CA 125.458 1.503 . . . . 0.0 111.533 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.4 m -78.55 -44.44 24.21 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.156 -1.59 . . . . 0.0 111.588 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -91.57 -20.66 21.44 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -133.92 62.26 56.63 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 124.833 1.253 . . . . 0.0 112.169 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -57.45 -27.49 76.33 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.994 3.129 . . . . 0.0 118.699 -164.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -115.48 11.97 16.1 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -76.01 134.73 71.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 O-C-N 121.57 -0.706 . . . . 0.0 110.479 170.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -55.54 -25.56 50.19 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.638 2.892 . . . . 0.0 113.932 175.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.0 p -55.01 -44.71 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 C-N-CA 125.339 1.456 . . . . 0.0 113.687 -175.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.04 -36.61 91.04 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -69.24 -36.68 77.44 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.122 0.969 . . . . 0.0 111.673 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.7 t -64.42 -42.91 95.78 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.361 -0.837 . . . . 0.0 112.278 172.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -75.43 -24.27 57.04 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -72.78 -37.43 67.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.212 1.005 . . . . 0.0 112.095 168.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.96 89.34 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.069 -1.019 . . . . 0.0 111.829 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.493 ' SD ' ' HE2' ' A' ' 50' ' ' LYS . 33.3 tpp -62.28 -45.53 92.84 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 112.135 171.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.26 -43.4 78.68 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.498 -0.751 . . . . 0.0 112.317 173.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.82 -41.03 92.32 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.699 0.8 . . . . 0.0 112.683 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 43.0 pt -68.85 -35.67 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.407 1.458 . . . . 0.0 112.287 172.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.2 OUTLIER -74.05 4.73 5.08 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 173.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.9 mt -122.19 3.55 9.82 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 128.26 2.624 . . . . 0.0 113.425 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.1 14.23 77.46 Favored Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.57 47.19 1.06 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.239 1.816 . . . . 0.0 111.86 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -60.05 -34.77 73.87 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.987 -1.071 . . . . 0.0 112.845 -171.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.32 -25.55 68.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.627 1.171 . . . . 0.0 112.532 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -81.29 -41.18 22.53 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.437 0.562 . . . . 0.0 111.054 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.76 88.54 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -175.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.2 pt -64.73 -35.15 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.779 0.718 . . . . 0.0 112.498 174.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -72.22 -44.23 63.24 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.782 0.833 . . . . 0.0 111.046 173.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.4 ttm -62.52 -30.02 70.99 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.885 0.874 . . . . 0.0 112.75 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 91.1 m -65.85 -39.14 90.48 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.99 -1.069 . . . . 0.0 112.113 171.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -70.67 -39.87 73.3 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.858 0.863 . . . . 0.0 112.077 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.07 -35.59 77.36 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.361 0.664 . . . . 0.0 111.529 166.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.22 -31.21 78.48 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 120.539 -1.351 . . . . 0.0 113.279 175.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 98.2 mt -63.56 -29.18 70.47 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.032 1.416 . . . . 0.0 112.808 173.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -66.39 -8.03 23.03 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 170.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -102.68 11.59 37.48 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.036 1.735 . . . . 0.0 112.606 168.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.8 p -126.97 19.28 7.1 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.568 1.547 . . . . 0.0 113.932 -178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 m -81.8 3.83 24.44 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.897 1.279 . . . . 0.0 113.725 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -143.26 150.56 39.44 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 111.328 -166.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.2 -26.1 37.11 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.945 2.202 . . . . 0.0 116.945 -161.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -74.61 -4.81 39.34 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.736 1.153 . . . . 0.0 113.97 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -135.51 11.78 3.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.787 1.235 . . . . 0.0 113.908 -168.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.01 -9.36 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 O-C-N 120.322 -1.486 . . . . 0.0 114.94 -175.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.93 24.52 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.39 0.996 . . . . 0.0 110.459 158.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mm -62.28 -27.89 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 O-C-N 120.866 -1.146 . . . . 0.0 112.041 174.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -48.35 -38.88 20.32 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.727 1.211 . . . . 0.0 112.438 168.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.7 m -79.36 -35.34 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.225 1.01 . . . . 0.0 113.465 170.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . 0.272 20.9 ttpt -73.69 9.66 1.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 170.464 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.89 -32.05 7.43 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.723 -1.236 . . . . 0.0 112.855 152.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -81.89 -31.39 31.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.51 -36.15 82.99 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 121.07 1.759 . . . . 0.0 110.191 163.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -63.55 -35.59 80.98 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.521 1.128 . . . . 0.0 111.446 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 21.3 tp -64.18 -45.04 90.11 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.014 1.325 . . . . 0.0 112.576 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -63.57 -32.53 74.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.058 -1.026 . . . . 0.0 113.062 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.9 -29.07 32.54 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.516 1.527 . . . . 0.0 112.499 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.02 -44.82 75.63 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.536 -1.352 . . . . 0.0 111.182 168.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -57.7 -27.34 62.84 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.793 0.837 . . . . 0.0 111.657 165.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.27 -61.8 6.26 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 128.885 3.136 . . . . 0.0 113.234 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.14 -31.28 68.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.866 1.266 . . . . 0.0 113.268 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 N--CA 1.482 1.128 0 CA-C-N 118.462 0.574 . . . . 0.0 111.742 170.363 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.37 -39.31 59.33 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.308 9.7 pt-20 -75.75 -10.0 59.06 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.33 0.968 . . . . 0.0 112.941 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -75.13 -57.53 3.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.254 1.422 . . . . 0.0 111.656 156.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -65.07 -34.93 79.59 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -167.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -65.18 -19.87 66.18 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -105.69 -21.36 13.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.616 1.566 . . . . 0.0 113.178 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -55.45 -34.73 64.75 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.158 1.345 . . . . 0.0 111.334 163.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -57.79 -28.96 61.02 Favored Glycine 0 CA--C 1.539 1.59 0 CA-C-O 119.016 -0.88 . . . . 0.0 114.724 172.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -60.76 -49.79 76.09 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.752 1.776 . . . . 0.0 111.87 174.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.5 t -68.92 -30.0 68.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.718 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 76.6 mt -64.31 -41.49 96.8 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.573 -1.329 . . . . 0.0 112.172 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -61.1 -34.94 75.75 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.376 -0.827 . . . . 0.0 112.643 168.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.2 -22.85 51.74 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -78.33 -26.31 46.8 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.436 1.094 . . . . 0.0 111.867 164.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.2 14.16 39.89 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.407 1.003 . . . . 0.0 113.951 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.43 58.62 4.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 127.228 2.211 . . . . 0.0 109.367 178.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -57.47 -36.45 71.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.782 0.833 . . . . 0.0 112.911 -172.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -79.86 -28.5 40.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.532 1.06 . . . . 0.0 111.553 -176.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -69.49 -38.11 77.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.664 0.785 . . . . 0.0 112.412 163.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -32.93 74.3 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 176.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.6 t -69.01 -38.97 79.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.138 0.975 . . . . 0.0 111.033 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -60.73 -33.77 73.41 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.141 -0.974 . . . . 0.0 113.002 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 p -74.01 -34.86 64.31 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 117.763 -1.113 . . . . 0.0 113.942 173.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.251 0.2 OUTLIER -67.09 -33.92 76.51 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.136 1.789 . . . . 0.0 111.693 169.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -62.53 -28.34 69.78 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.413 -0.804 . . . . 0.0 111.892 175.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -68.36 -33.8 74.93 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.709 -1.244 . . . . 0.0 112.539 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.63 -44.27 62.16 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.881 0.764 . . . . 0.0 109.19 177.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -70.85 -20.63 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.073 0.949 . . . . 0.0 112.103 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.5 m -68.63 -39.83 80.6 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.416 -1.428 . . . . 0.0 111.431 168.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -90.3 -28.22 18.91 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -177.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -132.29 60.26 49.64 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 126.151 1.78 . . . . 0.0 111.96 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -59.86 -26.56 82.66 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.195 2.596 . . . . 0.0 115.983 -170.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -106.97 4.44 27.17 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.492 1.517 . . . . 0.0 112.339 -170.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -93.13 130.32 36.4 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 120.813 -1.179 . . . . 0.0 112.969 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.41 -24.05 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.754 2.303 . . . . 0.0 114.107 174.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.49 -30.33 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 173.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.62 -42.35 55.01 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.357 -0.839 . . . . 0.0 111.121 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.45 -29.87 61.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 26.5 p -66.15 -42.9 88.42 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.105 1.321 . . . . 0.0 111.206 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -67.9 -44.51 76.81 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.475 0.71 . . . . 0.0 111.479 176.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -59.22 -41.91 89.76 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.851 0.86 . . . . 0.0 112.399 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.81 -37.29 86.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.379 0.991 . . . . 0.0 112.505 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.6 tpt -70.02 -39.58 75.71 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.626 0.648 . . . . 0.0 111.927 175.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.73 99.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.756 0.822 . . . . 0.0 111.735 172.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.84 -45.04 93.65 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.581 -0.699 . . . . 0.0 111.506 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 29.3 pt -68.44 -30.45 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.028 1.286 . . . . 0.0 112.87 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -11.37 59.85 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 175.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.6 tt -88.97 -29.08 19.79 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.07 1.748 . . . . 0.0 111.084 164.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 107.27 15.42 15.89 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.687 1.613 . . . . 0.0 114.695 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.93 48.71 1.06 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.312 2.245 . . . . 0.0 110.751 -178.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -59.85 -32.6 70.85 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.67 -1.269 . . . . 0.0 112.974 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 55.4 m -55.82 -31.35 62.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.162 1.785 . . . . 0.0 112.787 171.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -79.5 -39.08 32.9 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.669 0.788 . . . . 0.0 111.206 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.43 -39.61 89.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.869 0.868 . . . . 0.0 112.758 -176.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -65.2 -30.54 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.262 0.937 . . . . 0.0 112.912 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -77.35 -36.23 53.96 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.988 0.915 . . . . 0.0 111.698 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.9 ttm -66.65 -30.97 71.36 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 0.0 112.561 173.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 86.8 m -61.92 -43.16 99.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.321 -0.862 . . . . 0.0 111.927 171.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -65.94 -40.0 90.97 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.756 1.223 . . . . 0.0 112.916 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.26 -27.68 69.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.153 0.581 . . . . 0.0 112.312 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -22.17 61.25 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 120.606 -1.309 . . . . 0.0 114.717 174.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.582 ' CD2' HE22 ' A' ' 81' ' ' GLN . 42.4 mt -59.21 -27.35 65.65 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.847 1.824 . . . . 0.0 112.263 171.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -59.88 -10.76 4.33 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.397 1.879 . . . . 0.0 115.458 174.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -124.28 42.0 3.36 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.331 1.853 . . . . 0.0 112.712 -168.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.2 p -129.88 -12.68 4.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -164.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 60.4 m -81.64 49.46 1.33 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -168.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.2 t -164.07 153.35 13.96 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.904 1.681 . . . . 0.0 110.518 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.77 -11.08 32.73 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 120.993 -1.067 . . . . 0.0 113.139 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.49 -31.82 73.09 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.618 1.167 . . . . 0.0 111.932 165.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -130.87 16.87 5.19 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.238 1.415 . . . . 0.0 113.82 -169.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.6 p -69.98 -28.1 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 120.505 -1.372 . . . . 0.0 113.069 178.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.65 -34.99 22.93 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.36 0.664 . . . . 0.0 111.294 170.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 12.8 mm -51.38 -41.72 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 121.468 -0.77 . . . . 0.0 111.052 166.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -55.26 -47.33 75.62 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.847 0.749 . . . . 0.0 111.533 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.6 m -61.86 -42.29 98.87 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.975 1.31 . . . . 0.0 111.875 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -70.32 -4.02 20.13 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.577 1.551 . . . . 0.0 114.153 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -102.76 -31.62 10.23 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.8 1.182 . . . . 0.0 112.983 157.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.582 HE22 ' CD2' ' A' ' 65' ' ' LEU . 10.7 mm-40 -61.12 -53.59 55.14 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.837 1.653 . . . . 0.0 112.079 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -33.65 68.59 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.288 0.495 . . . . 0.0 111.105 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 tpp85 -66.3 -33.2 75.21 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.678 1.191 . . . . 0.0 111.684 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tt -66.82 -50.78 61.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.39 0.676 . . . . 0.0 110.445 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.03 -37.16 71.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 177.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.32 -26.35 35.7 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.925 1.29 . . . . 0.0 112.689 178.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.71 -42.62 90.89 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.743 1.61 . . . . 0.0 110.484 169.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.51 -29.54 70.57 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.453 0.701 . . . . 0.0 111.274 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.93 -60.33 8.61 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 127.756 2.598 . . . . 0.0 113.694 172.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.61 -27.24 68.51 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.419 1.887 . . . . 0.0 113.027 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 175.762 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 CA--C 1.545 0.767 0 N-CA-C 111.309 0.115 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -15.42 60.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 174.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -75.49 -50.89 14.33 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.756 -1.215 . . . . 0.0 111.429 164.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.276 0.0 OUTLIER -67.22 -29.4 69.04 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.853 1.206 . . . . 0.0 113.658 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.34 -39.14 71.51 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.023 1.283 . . . . 0.0 112.764 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -65.99 -20.44 66.19 Favored 'General case' 0 N--CA 1.485 1.289 0 O-C-N 120.886 -1.134 . . . . 0.0 113.111 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -95.54 -32.44 12.84 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.096 0.958 . . . . 0.0 112.568 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -59.07 -42.94 91.55 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.253 1.021 . . . . 0.0 111.045 170.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.6 -39.65 61.12 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-N 118.82 0.736 . . . . 0.0 113.753 173.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -70.1 -39.9 75.24 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.607 1.204 . . . . 0.0 111.178 177.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.3 t -60.29 -43.08 96.58 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 122.782 0.433 . . . . 0.0 111.426 172.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.8 mt -59.38 -40.66 87.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.222 -0.924 . . . . 0.0 111.652 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.141 1.337 . . . . 0.0 113.022 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.444 ' N ' ' HE2' ' A' ' 16' ' ' LYS . 1.1 mpmm? -68.11 -18.21 64.58 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 175.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -91.89 -7.14 50.08 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.912 1.285 . . . . 0.0 113.124 166.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.21 9.22 86.84 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 121.136 -0.977 . . . . 0.0 114.965 -175.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.0 mt -80.23 46.86 0.86 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.888 2.075 . . . . 0.0 111.893 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -50.7 -41.68 56.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.012 1.725 . . . . 0.0 113.431 -173.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -73.28 -27.4 61.54 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.288 0.949 . . . . 0.0 111.76 -175.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -81.88 -36.07 28.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.507 0.723 . . . . 0.0 111.065 170.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.24 71.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.624 1.17 . . . . 0.0 113.079 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.7 t -56.98 -40.86 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.771 1.228 . . . . 0.0 110.922 177.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.61 -42.07 98.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.538 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -61.26 -46.21 91.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 0.0 112.149 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -65.46 -33.23 75.45 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -69.62 -28.04 65.58 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.708 0.686 . . . . 0.0 112.362 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -66.42 -31.65 72.54 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.525 1.057 . . . . 0.0 112.096 173.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.3 mt -58.3 -37.7 75.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.423 1.011 . . . . 0.0 111.209 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -79.51 -22.92 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 122.711 0.405 . . . . 0.0 111.888 177.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -69.77 -41.46 75.14 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.798 -1.189 . . . . 0.0 111.083 169.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.21 -34.54 23.9 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -176.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -124.67 66.56 47.52 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 125.345 1.458 . . . . 0.0 112.697 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -58.39 -22.4 58.31 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.632 2.888 . . . . 0.0 119.01 -166.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -122.23 16.3 10.65 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.54 1.064 . . . . 0.0 112.653 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -89.5 124.29 64.65 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 111.215 174.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.24 -16.35 53.9 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.417 2.078 . . . . 0.0 113.949 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.4 p -51.58 -46.77 37.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.56 1.073 . . . . 0.0 111.892 171.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.26 -43.42 92.95 Favored Glycine 0 C--N 1.34 0.766 0 C-N-CA 123.522 0.582 . . . . 0.0 111.934 -176.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -58.89 -37.81 77.44 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 117.611 0.705 . . . . 0.0 112.431 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.4 p -65.35 -38.05 88.93 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.774 -1.204 . . . . 0.0 112.886 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -76.02 -37.11 58.79 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.83 0.852 . . . . 0.0 111.995 178.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.18 -33.46 70.01 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.9 -1.125 . . . . 0.0 112.505 175.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.43 83.49 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 120.922 -1.112 . . . . 0.0 111.717 166.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.4 tpt -63.35 -43.45 97.67 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.128 0.571 . . . . 0.0 111.812 173.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.16 -44.78 83.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.084 0.954 . . . . 0.0 112.1 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -64.18 -34.25 77.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.75 0.82 . . . . 0.0 112.848 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.3 pt -80.54 -17.14 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.735 1.152 . . . . 0.0 114.07 171.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.41 -13.13 53.03 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.466 1.506 . . . . 0.0 113.222 171.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 tt -101.82 -38.68 7.74 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.914 2.086 . . . . 0.0 112.077 173.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.19 22.44 5.88 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 124.726 1.155 . . . . 0.0 115.678 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -103.75 53.89 0.75 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.598 1.19 . . . . 0.0 109.094 169.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.51 -34.0 66.57 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 112.83 -173.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.9 m -64.82 -26.34 68.3 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.89 0.768 . . . . 0.0 112.144 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -75.62 -33.4 60.51 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.034 -1.041 . . . . 0.0 112.015 169.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.0 -40.59 71.76 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 112.75 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 25.4 pt -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.938 0.79 . . . . 0.0 112.068 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -62.38 -46.83 86.85 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.882 0.873 . . . . 0.0 110.985 170.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 50.3 ttm -62.2 -32.28 72.91 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.59 -0.693 . . . . 0.0 112.834 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.73 -49.53 62.13 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.051 -1.031 . . . . 0.0 112.031 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.43 -33.96 77.17 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 122.971 0.509 . . . . 0.0 111.811 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -26.37 68.03 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.462 1.505 . . . . 0.0 113.349 169.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.44 -31.55 37.06 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 120.335 -1.478 . . . . 0.0 114.11 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.0 -32.01 70.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.611 1.705 . . . . 0.0 112.161 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -52.77 -22.63 5.53 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.48 1.512 . . . . 0.0 114.581 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -81.42 -12.83 58.81 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.439 1.495 . . . . 0.0 114.145 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -103.03 10.57 38.04 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 118.188 2.662 . . . . 0.0 118.188 -148.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -76.71 37.24 0.17 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.5 t -151.59 148.55 28.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.591 1.556 . . . . 0.0 111.278 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.31 -15.47 16.24 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 172.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -67.77 -26.83 66.31 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.174 0.897 . . . . 0.0 112.111 169.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -128.03 17.09 6.72 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.683 1.593 . . . . 0.0 113.665 -174.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.2 p -63.42 -31.17 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 120.093 -1.63 . . . . 0.0 112.595 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.02 -10.5 59.77 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.02 1.328 . . . . 0.0 113.756 174.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.3 mm -84.3 -35.85 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.829 1.251 . . . . 0.0 110.339 168.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -57.2 -39.35 75.24 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.694 1.198 . . . . 0.0 111.731 176.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.2 p -71.14 -47.5 57.49 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.082 0.953 . . . . 0.0 112.544 171.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 mttm -48.56 -57.26 6.45 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.403 1.002 . . . . 0.0 111.838 176.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.15 -30.07 67.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 117.979 -1.01 . . . . 0.0 112.976 -173.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -76.55 -38.06 55.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.651 1.569 . . . . 0.0 113.602 175.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.23 -39.2 65.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.703 1.138 . . . . 0.0 111.321 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.369 15.6 ptp180 -77.04 -11.24 59.78 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.448 1.476 . . . . 0.0 114.412 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.5 -41.44 55.32 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.248 1.019 . . . . 0.0 112.171 161.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.62 -39.19 83.45 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.104 -0.998 . . . . 0.0 111.343 167.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.47 -28.05 41.54 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.394 1.078 . . . . 0.0 113.572 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.72 89.07 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.751 1.16 . . . . 0.0 110.986 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.0 -26.96 68.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.839 0.856 . . . . 0.0 111.423 170.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.28 -49.65 55.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.728 2.109 . . . . 0.0 114.421 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.99 -27.14 61.62 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.611 -0.935 . . . . 0.0 112.562 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 N--CA 1.483 1.216 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -178.726 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 mp0 . . . . . 0 CA--C 1.546 0.805 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -34.52 26.13 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.614 1.097 . . . . 0.0 112.981 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -64.06 -23.51 67.35 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.502 1.521 . . . . 0.0 112.535 167.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.85 -46.34 25.07 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 125.962 1.705 . . . . 0.0 111.314 171.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -70.51 -27.25 64.04 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -62.53 -29.19 70.39 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 119.303 0.956 . . . . 0.0 112.967 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -85.83 -30.21 23.15 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 172.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.13 -43.88 91.99 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.983 -1.073 . . . . 0.0 111.091 171.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.22 91.44 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-O 119.231 -0.76 . . . . 0.0 114.079 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -55.21 -54.05 48.32 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.551 1.175 . . . . 0.0 110.358 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.6 t -57.86 -43.69 86.13 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.406 1.082 . . . . 0.0 112.166 177.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.33 -33.07 73.0 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.211 -0.931 . . . . 0.0 112.937 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -66.16 -40.04 90.24 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.844 1.202 . . . . 0.0 113.131 171.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -61.53 -40.43 94.63 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.708 -0.62 . . . . 0.0 112.151 173.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -18.85 64.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.417 1.265 . . . . 0.0 114.417 171.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.99 11.93 69.21 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 123.94 0.781 . . . . 0.0 114.864 -176.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.4 mt -89.03 57.52 4.15 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.234 1.814 . . . . 0.0 109.903 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -56.8 -39.24 73.77 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.939 1.295 . . . . 0.0 114.056 -170.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -83.33 -27.99 29.36 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.124 0.874 . . . . 0.0 111.582 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -70.74 -33.2 70.57 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.175 0.443 . . . . 0.0 111.925 164.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.31 -49.11 68.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.661 0.664 . . . . 0.0 111.803 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.3 t -59.05 -37.03 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.981 -1.009 . . . . 0.0 111.02 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -54.99 -42.14 72.09 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.859 1.209 . . . . 0.0 112.912 174.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.3 m -66.46 -37.06 84.3 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.091 0.859 . . . . 0.0 112.685 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -75.06 -38.27 61.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -64.23 -35.72 81.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.26 0.624 . . . . 0.0 110.636 173.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -23.31 66.4 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 173.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.3 mt -60.61 -42.17 96.29 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.146 1.339 . . . . 0.0 109.46 168.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.1 mt -82.95 -28.6 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.4 1.48 . . . . 0.0 112.147 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -58.5 -32.87 69.2 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.662 -1.274 . . . . 0.0 111.512 168.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -89.61 -29.09 19.09 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 175.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -136.16 68.85 63.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 124.987 1.315 . . . . 0.0 110.774 -168.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -61.29 -36.8 77.53 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.291 1.994 . . . . 0.0 115.552 -163.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.37 6.8 38.94 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -174.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -105.24 130.49 23.01 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -158.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.49 -17.31 53.09 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.555 2.17 . . . . 0.0 113.414 168.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.78 2.44 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.613 1.565 . . . . 0.0 114.7 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -116.6 -36.97 1.02 Allowed Glycine 0 CA--C 1.531 1.09 0 O-C-N 121.5 -0.75 . . . . 0.0 112.679 155.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -60.29 -44.05 95.72 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.036 1.418 . . . . 0.0 112.881 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.4 p -67.8 -27.36 66.67 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.658 -0.651 . . . . 0.0 112.294 -177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -84.04 -42.24 16.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.495 . . . . 0.0 110.908 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -64.66 -32.12 73.64 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.245 -0.909 . . . . 0.0 112.335 172.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.49 -37.04 85.76 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.125 -0.984 . . . . 0.0 112.633 170.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 tpt -66.14 -38.74 88.87 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.856 0.862 . . . . 0.0 111.735 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.8 -42.35 93.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.409 0.684 . . . . 0.0 111.831 174.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.2 -36.68 84.93 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 118.58 -0.724 . . . . 0.0 112.68 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.3 pt -68.49 -33.84 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.312 1.415 . . . . 0.0 112.37 169.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.79 -12.33 60.02 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 -17.14 38.28 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.917 2.087 . . . . 0.0 111.039 163.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.8 22.09 56.34 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.856 1.217 . . . . 0.0 114.308 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -107.73 57.94 0.62 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.891 1.676 . . . . 0.0 110.123 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -56.21 -36.22 68.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.579 1.552 . . . . 0.0 112.497 -175.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.6 m -62.27 -26.73 68.56 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.387 0.994 . . . . 0.0 112.625 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -84.09 -28.74 27.33 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.511 -0.743 . . . . 0.0 111.93 172.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.16 -36.43 58.75 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.177 0.991 . . . . 0.0 113.298 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -68.17 -32.08 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.023 0.829 . . . . 0.0 111.996 175.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -61.55 -50.48 72.47 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.22 0.608 . . . . 0.0 110.049 166.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.5 ttm -69.09 -32.41 71.82 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -174.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -70.35 -39.59 74.58 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.827 -1.171 . . . . 0.0 112.034 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -73.07 -28.68 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.736 1.153 . . . . 0.0 113.394 171.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -32.12 73.51 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.878 -1.139 . . . . 0.0 111.265 166.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.11 -22.7 73.28 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-O 117.87 -1.516 . . . . 0.0 114.514 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.6 mt -56.84 -29.71 63.08 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.288 2.044 . . . . 0.0 112.313 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -64.7 -1.13 1.71 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.193 1.797 . . . . 0.0 114.516 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -130.41 37.65 3.83 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.553 1.941 . . . . 0.0 111.482 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -129.73 -14.19 4.1 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 -167.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.6 m -80.12 22.4 0.52 Allowed 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -163.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 p -141.33 161.27 38.3 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 119.659 1.118 . . . . 0.0 111.97 -173.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.57 67.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -66.91 -18.22 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.237 1.015 . . . . 0.0 113.068 170.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -126.63 14.89 7.59 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.261 1.424 . . . . 0.0 113.88 -173.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.29 -29.99 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.975 -1.078 . . . . 0.0 113.055 177.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.76 -44.94 54.65 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.067 -1.021 . . . . 0.0 110.886 170.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.87 -35.84 53.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.275 1.43 . . . . 0.0 112.459 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 21.6 ttp-105 -58.83 -39.72 82.06 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.23 1.012 . . . . 0.0 112.219 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -77.7 -39.2 45.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.569 1.148 . . . . 0.0 112.234 172.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -68.59 -16.93 64.02 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -178.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -91.07 -32.09 16.01 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.053 1.297 . . . . 0.0 113.705 163.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -78.55 -42.3 29.68 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.402 1.455 . . . . 0.0 113.319 -175.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -34.86 78.74 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.969 1.259 . . . . 0.0 110.814 171.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -67.39 -36.93 82.28 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.681 1.593 . . . . 0.0 111.989 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.0 tp -67.96 -39.38 83.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.716 1.206 . . . . 0.0 112.051 170.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.5 -39.89 94.95 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.265 -0.897 . . . . 0.0 112.383 169.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.9 -29.51 62.1 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.981 1.264 . . . . 0.0 112.863 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.47 96.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.96 -1.088 . . . . 0.0 111.169 167.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -69.99 -19.89 63.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.216 1.006 . . . . 0.0 112.566 172.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -65.86 -62.8 4.46 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.819 2.152 . . . . 0.0 112.757 168.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.97 63.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -175.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.476 0.826 0 O-C-N 121.101 -0.999 . . . . 0.0 112.933 171.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 120.83 0.347 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.37 60.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.045 0.938 . . . . 0.0 113.298 176.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.22 -45.13 57.98 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 120.772 -1.205 . . . . 0.0 111.656 165.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -25.63 60.35 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.446 1.475 . . . . 0.0 113.855 178.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -75.58 -26.57 58.03 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.363 0.983 . . . . 0.0 113.274 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -69.33 -39.23 78.32 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.003 -1.061 . . . . 0.0 111.725 170.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.0 -39.06 93.27 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 169.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -59.44 -43.03 93.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.853 0.861 . . . . 0.0 111.479 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.23 -56.15 25.77 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 118.783 0.72 . . . . 0.0 112.183 173.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -54.89 -42.97 72.77 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.942 0.897 . . . . 0.0 111.852 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.8 t -68.88 -38.88 79.96 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.951 1.701 . . . . 0.0 113.43 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.4 mt -65.88 -35.36 80.43 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.779 -1.201 . . . . 0.0 111.322 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -63.3 -40.67 97.99 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.362 0.983 . . . . 0.0 112.269 169.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.06 -33.53 76.0 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.344 -0.847 . . . . 0.0 112.618 177.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.02 -30.82 55.96 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.456 1.102 . . . . 0.0 113.399 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.78 12.36 20.96 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.433 1.492 . . . . 0.0 115.12 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.77 53.79 2.94 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.058 1.743 . . . . 0.0 109.642 174.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -57.61 -36.32 71.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.57 1.148 . . . . 0.0 113.606 -168.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mmt-85 -75.84 -38.37 58.09 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.943 -1.098 . . . . 0.0 111.726 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.78 -31.91 71.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.694 0.397 . . . . 0.0 111.632 172.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.16 98.56 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.04 0.936 . . . . 0.0 112.65 171.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.72 -41.27 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.735 0.814 . . . . 0.0 111.299 173.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.1 m-70 -59.65 -38.46 81.48 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.226 0.921 . . . . 0.0 112.568 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 m -66.28 -26.46 67.34 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 117.72 -1.133 . . . . 0.0 113.573 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.93 -37.49 39.64 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 121.022 1.737 . . . . 0.0 112.261 168.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.87 -29.95 71.14 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.097 0.862 . . . . 0.0 112.094 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -66.64 -36.52 82.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.896 172.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.0 mt -63.8 -41.79 97.84 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.838 1.199 . . . . 0.0 111.217 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.21 -23.09 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.896 0.879 . . . . 0.0 111.019 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.4 m -78.17 -40.81 36.64 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.275 -0.89 . . . . 0.0 111.582 171.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.66 -31.5 24.14 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -129.69 66.39 77.14 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 126.169 1.787 . . . . 0.0 112.02 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -60.01 -26.69 83.11 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 123.297 2.664 . . . . 0.0 116.91 -170.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -106.56 5.86 29.51 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.456 1.503 . . . . 0.0 112.128 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.4 137.63 32.4 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 121.017 -1.052 . . . . 0.0 111.893 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -63.39 -22.78 71.67 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.176 1.917 . . . . 0.0 114.039 176.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.1 p -57.82 -42.09 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.971 1.308 . . . . 0.0 113.702 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.65 -40.39 46.37 Favored Glycine 0 N--CA 1.468 0.829 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -64.3 -37.34 87.14 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.239 1.02 . . . . 0.0 111.769 173.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.4 m -59.39 -30.22 68.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.961 0.904 . . . . 0.0 112.676 172.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.274 6.0 m120 -103.36 -16.07 15.74 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -176.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -65.96 -43.09 88.95 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.187 0.903 . . . . 0.0 110.648 155.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.35 89.26 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.143 -0.973 . . . . 0.0 112.661 170.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.2 tpt -62.61 -44.21 96.88 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.606 0.762 . . . . 0.0 112.324 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -46.03 89.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.178 0.991 . . . . 0.0 111.94 175.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.5 mt -59.45 -38.83 81.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.48 0.712 . . . . 0.0 112.349 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.4 pt -77.51 -27.98 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.758 1.163 . . . . 0.0 112.929 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -12.6 61.02 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 171.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 mt -118.16 -5.94 10.9 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.866 2.066 . . . . 0.0 114.957 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.32 45.37 8.13 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 119.264 0.938 . . . . 0.0 115.319 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -118.04 49.57 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.821 1.649 . . . . 0.0 110.094 169.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.27 -35.05 71.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.474 1.11 . . . . 0.0 112.959 -168.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.6 m -65.01 -31.26 72.4 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.625 1.17 . . . . 0.0 112.52 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -81.36 -31.31 33.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.087 0.555 . . . . 0.0 110.957 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.44 -44.95 85.71 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.712 -0.618 . . . . 0.0 111.621 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.9 pt -63.95 -29.69 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.997 0.817 . . . . 0.0 113.072 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -63.82 -49.62 72.13 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.49 0.716 . . . . 0.0 110.81 168.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 30.1 ttm -69.61 -26.2 64.32 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 71.0 m -60.25 -45.65 92.52 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.437 -0.789 . . . . 0.0 111.307 170.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -71.13 -40.57 71.31 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.461 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.91 -34.1 71.31 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.3 -0.875 . . . . 0.0 111.756 171.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.81 -20.22 74.04 Favored Glycine 0 CA--C 1.533 1.204 0 O-C-N 120.66 -1.275 . . . . 0.0 115.025 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.18 -35.19 73.13 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.971 1.886 . . . . 0.0 111.17 166.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -72.55 -2.56 20.27 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -105.89 -5.12 19.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.953 1.301 . . . . 0.0 112.699 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 74.4 p -137.75 0.97 2.27 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -162.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.4 m -82.04 54.34 2.47 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.613 1.097 . . . . 0.0 111.918 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.6 t -157.94 151.37 23.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.764 1.626 . . . . 0.0 111.867 -175.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -47.96 -31.43 5.26 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.149 1.78 . . . . 0.0 115.312 -177.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -82.83 1.58 38.47 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -145.64 17.8 1.48 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 126.264 1.826 . . . . 0.0 113.625 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -64.34 -25.7 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.643 1.719 . . . . 0.0 115.643 -171.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.96 -20.13 20.27 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.546 1.538 . . . . 0.0 111.859 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.4 mm -70.43 -38.22 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 O-C-N 121.285 -0.884 . . . . 0.0 109.685 163.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -52.96 -43.44 66.38 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.071 0.948 . . . . 0.0 110.66 173.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -57.4 -39.98 77.27 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.613 1.565 . . . . 0.0 113.944 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.29 -47.02 82.55 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.307 1.412 . . . . 0.0 111.765 169.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.12 -32.99 72.77 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 120.037 1.29 . . . . 0.0 113.21 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -62.17 -50.31 72.36 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.374 1.443 . . . . 0.0 110.92 169.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . 0.255 0.0 OUTLIER -71.69 -31.13 66.43 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -173.94 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -52.37 -43.89 64.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.105 0.866 . . . . 0.0 110.87 165.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.38 -38.59 74.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.936 0.895 . . . . 0.0 111.945 -178.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.84 -34.18 77.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.832 1.253 . . . . 0.0 112.339 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -93.0 -11.93 31.93 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 174.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.35 -54.14 13.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.084 1.311 . . . . 0.0 110.166 165.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -70.07 -22.19 63.08 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 175.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.96 -60.67 5.86 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.316 2.388 . . . . 0.0 114.418 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.75 60.82 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.568 1.184 . . . . 0.0 113.386 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 171.098 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.2 tpp . . . . . 0 N--CA 1.484 1.271 0 CA-C-O 121.576 0.703 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.1 m -68.06 -22.29 64.95 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 119.417 -2.052 . . . . 0.0 113.68 -169.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -55.4 -37.88 68.17 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.402 -0.811 . . . . 0.0 112.414 175.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -10.92 60.09 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -88.83 -36.7 15.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.115 1.366 . . . . 0.0 111.92 172.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -80.19 -24.28 40.41 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.42 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.5 -30.2 62.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.371 0.987 . . . . 0.0 112.791 175.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -73.38 -33.03 64.82 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.952 -1.093 . . . . 0.0 112.971 171.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.15 -36.72 83.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.505 0.722 . . . . 0.0 112.614 169.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.48 -44.54 93.03 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.376 -0.827 . . . . 0.0 110.544 168.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.11 -50.53 58.83 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.556 0.598 . . . . 0.0 113.384 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -61.49 -40.71 95.54 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 118.432 1.116 . . . . 0.0 112.011 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -64.14 -36.94 85.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.388 1.075 . . . . 0.0 112.383 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.5 mt -69.8 -39.02 76.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.341 1.057 . . . . 0.0 112.114 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -61.49 -28.51 69.35 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 118.932 0.787 . . . . 0.0 112.533 167.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.8 -7.34 54.2 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -110.98 -31.32 7.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.953 1.301 . . . . 0.0 112.859 172.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.8 9.15 14.48 Favored Glycine 0 N--CA 1.476 1.31 0 C-N-CA 124.216 0.912 . . . . 0.0 114.474 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.84 54.87 3.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.994 1.717 . . . . 0.0 110.293 176.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -57.23 -34.51 68.65 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.008 0.923 . . . . 0.0 113.26 -171.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.23 -32.76 56.06 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.311 1.414 . . . . 0.0 111.845 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.92 -32.97 65.68 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 118.668 0.667 . . . . 0.0 111.969 168.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.45 -41.03 85.37 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.905 -1.122 . . . . 0.0 112.298 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.4 t -62.02 -39.74 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.545 1.138 . . . . 0.0 110.89 168.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -56.91 -32.47 65.96 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.314 0.961 . . . . 0.0 112.369 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.7 m -71.71 -39.74 69.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.259 -0.877 . . . . 0.0 113.295 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -38.71 75.05 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.301 1.409 . . . . 0.0 111.081 172.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -61.13 -32.17 71.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.107 1.363 . . . . 0.0 111.855 177.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -60.99 -40.08 92.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.671 1.123 . . . . 0.0 112.072 171.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.22 -42.8 88.2 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.774 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.1 mt -76.18 -22.52 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.123 0.969 . . . . 0.0 111.188 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 55.6 m -67.96 -41.92 81.68 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.891 -1.756 . . . . 0.0 111.222 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.32 -20.9 26.13 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.83 65.22 37.76 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.655 1.582 . . . . 0.0 110.809 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -61.93 -22.95 75.31 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.581 2.854 . . . . 0.0 117.27 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -123.33 10.68 9.28 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.42 1.488 . . . . 0.0 111.27 -170.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -90.64 131.77 36.94 Favored Pre-proline 0 CA--C 1.544 0.737 0 O-C-N 120.574 -1.329 . . . . 0.0 111.292 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.75 -17.46 60.01 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.683 2.255 . . . . 0.0 114.065 177.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.7 p -53.55 -42.67 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 119.028 0.831 . . . . 0.0 111.926 170.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.55 -37.97 85.81 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.18 -0.95 . . . . 0.0 111.624 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -69.84 -35.24 74.6 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.556 0.742 . . . . 0.0 112.64 175.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.6 t -61.26 -36.77 80.92 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.073 -1.017 . . . . 0.0 112.469 170.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -77.97 -28.49 49.43 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.513 0.725 . . . . 0.0 112.57 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -68.17 -41.94 80.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.873 1.215 . . . . 0.0 111.65 166.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.07 81.44 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.119 -0.988 . . . . 0.0 112.404 173.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -61.53 -49.41 76.82 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.269 1.028 . . . . 0.0 111.457 169.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.57 82.35 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.258 0.623 . . . . 0.0 112.221 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.3 mt -62.08 -42.85 99.63 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.894 0.878 . . . . 0.0 112.598 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.14 -20.73 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 119.55 1.068 . . . . 0.0 113.123 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.24 -8.27 56.99 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.604 1.162 . . . . 0.0 114.061 172.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.4 7.79 21.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.68 1.992 . . . . 0.0 112.735 170.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.16 17.98 79.65 Favored Glycine 0 CA--C 1.535 1.343 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 174.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -104.28 52.83 0.75 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.848 1.659 . . . . 0.0 110.75 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.64 -29.89 64.94 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.101 1.36 . . . . 0.0 112.683 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 m -62.99 -27.67 69.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.679 0.792 . . . . 0.0 112.506 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -77.02 -40.86 44.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.176 0.898 . . . . 0.0 111.299 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.09 93.22 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.385 -0.822 . . . . 0.0 113.005 -175.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.7 pt -63.88 -30.66 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -78.24 -45.56 22.61 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.6 171.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.9 ttm -65.13 -28.87 69.72 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.162 -0.961 . . . . 0.0 113.083 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.9 m -66.42 -39.93 89.25 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.99 -1.069 . . . . 0.0 112.295 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -62.71 -45.73 91.37 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.036 0.835 . . . . 0.0 110.391 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.99 -37.06 68.61 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.87 -23.65 59.32 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.224 1.375 . . . . 0.0 115.066 177.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.74 -18.93 65.68 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.57 1.685 . . . . 0.0 112.416 171.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -72.14 5.01 3.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.443 1.497 . . . . 0.0 114.829 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -121.35 44.18 2.61 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.475 1.91 . . . . 0.0 111.037 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.0 p -132.13 -2.19 3.6 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -164.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 81.6 p -63.93 -15.85 60.1 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 -164.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 p -120.17 165.97 14.06 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 120.586 1.539 . . . . 0.0 113.7 -173.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.82 -0.86 1.64 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.1 1.36 . . . . 0.0 114.594 174.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -83.32 -17.63 41.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.344 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -129.98 15.09 5.78 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.492 1.517 . . . . 0.0 114.203 -166.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.54 -30.34 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 120.494 -1.379 . . . . 0.0 112.32 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.55 -38.81 81.11 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.176 -0.953 . . . . 0.0 112.086 171.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.2 mm -61.56 -37.93 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.593 1.157 . . . . 0.0 110.687 174.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.09 -44.37 96.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.607 1.163 . . . . 0.0 112.619 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 t -63.78 -48.54 76.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 111.892 167.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.3 ttpt -58.0 -44.43 87.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 112.939 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.05 -24.47 51.98 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.779 1.172 . . . . 0.0 113.794 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.96 -34.2 59.81 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.278 1.399 . . . . 0.0 113.459 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -35.37 58.59 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.116 0.871 . . . . 0.0 111.647 168.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -57.76 -40.58 80.1 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.039 1.29 . . . . 0.0 111.659 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -65.69 -41.76 92.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.933 0.893 . . . . 0.0 112.874 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.817 0.847 . . . . 0.0 111.017 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.21 -20.03 35.37 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.77 -50.88 65.07 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.925 1.239 . . . . 0.0 110.329 164.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.86 -28.25 69.36 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.927 0.891 . . . . 0.0 111.964 171.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.24 -55.68 17.47 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 127.535 2.493 . . . . 0.0 112.591 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.69 76.52 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.986 1.714 . . . . 0.0 112.56 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.3 p -82.97 -41.79 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 175.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -87.89 -20.38 50.48 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 116.046 1.179 . . . . 0.0 116.046 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.7 m -74.26 145.91 43.65 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.944 1.372 . . . . 0.0 111.906 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 35.4 m -129.66 -6.79 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.533 1.533 . . . . 0.0 113.181 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . 0.302 16.1 tm0? 64.09 -6.45 0.26 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 128.61 2.764 . . . . 0.0 116.844 176.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mt -82.79 116.2 62.71 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.19 0.996 . . . . 0.0 110.1 172.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -84.66 -15.59 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.679 2.92 . . . . 0.0 113.673 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 t 61.99 18.08 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 126.406 1.882 . . . . 0.0 114.763 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.9 m -150.22 155.9 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 127.832 2.453 . . . . 0.0 109.567 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 54.31 -157.0 0.2 Allowed 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 125.307 1.443 . . . . 0.0 114.002 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.4 m -139.63 20.94 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 125.283 1.433 . . . . 0.0 113.814 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.87 -41.27 91.83 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.27 1.428 . . . . 0.0 113.073 -170.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -130.35 -74.9 0.54 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.518 -0.739 . . . . 0.0 111.269 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 58.5 mt 61.38 158.51 0.11 Allowed Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 127.231 2.212 . . . . 0.0 115.246 -176.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -62.6 168.77 9.43 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.485 2.123 . . . . 0.0 111.542 152.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -68.12 138.15 55.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 112.491 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 73.14 -113.55 4.36 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -166.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 28.6 t80 61.36 -69.74 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.108 2.563 . . . . 0.0 115.491 -177.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -140.49 21.54 2.37 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -170.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -134.29 33.31 3.34 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 C--O 1.25 1.108 0 C-N-CA 126.576 1.95 . . . . 0.0 111.097 179.374 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.5 mpt? . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -109.7 149.31 29.93 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.912 0.885 . . . . 0.0 112.176 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -150.33 108.7 3.78 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.528 1.531 . . . . 0.0 108.891 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 74.7 t 65.84 132.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.274 1.83 . . . . 0.0 115.017 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 . . . . . 0 C--O 1.256 1.416 0 C-N-CA 126.46 1.904 . . . . 0.0 114.158 -166.024 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 111.362 0.134 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -59.53 -30.07 68.33 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -168.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -65.37 -30.02 70.8 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.5 1.5 . . . . 0.0 112.608 176.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.61 -30.88 66.29 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.103 -0.998 . . . . 0.0 112.527 177.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.45 -28.12 64.77 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.034 1.734 . . . . 0.0 112.48 165.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.34 -45.61 17.49 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.742 0.817 . . . . 0.0 112.9 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -66.28 -27.17 67.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.882 1.219 . . . . 0.0 112.858 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -64.01 -45.93 86.75 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.604 1.093 . . . . 0.0 111.571 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.77 -34.78 60.27 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 -39.8 71.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.958 1.254 . . . . 0.0 111.649 175.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.97 -35.26 91.77 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 120.925 -1.109 . . . . 0.0 112.714 170.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -62.23 -40.46 96.21 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.127 -1.219 . . . . 0.0 112.111 169.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.3 t -63.23 -35.85 81.69 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.513 -0.742 . . . . 0.0 112.151 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.4 mt -65.98 -36.93 84.65 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.606 -1.308 . . . . 0.0 112.482 172.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.73 -33.56 76.15 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.651 1.114 . . . . 0.0 112.228 167.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.9 -2.28 17.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.573 1.549 . . . . 0.0 114.598 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -113.28 -50.74 2.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.495 1.918 . . . . 0.0 112.35 175.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.3 0.23 3.41 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.863 1.22 . . . . 0.0 115.34 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -85.33 51.99 2.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.749 2.42 . . . . 0.0 111.319 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.88 -33.57 70.64 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.987 1.315 . . . . 0.0 113.15 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -68.7 -47.11 67.22 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.927 1.24 . . . . 0.0 110.351 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.41 -36.58 79.31 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.325 0.39 . . . . 0.0 111.41 176.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.16 77.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.318 0.647 . . . . 0.0 112.62 176.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.2 t -62.43 -37.28 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.674 0.79 . . . . 0.0 110.77 174.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -61.02 -39.2 88.85 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.037 0.835 . . . . 0.0 112.651 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -66.04 -40.96 91.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.44 0.696 . . . . 0.0 112.199 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -68.4 -37.31 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.609 -0.682 . . . . 0.0 112.485 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.766 ' HD2' ' HZ2' ' A' ' 44' ' ' LYS . 10.7 m-20 -63.56 -26.14 68.56 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 171.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -76.69 -26.89 55.24 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.746 1.157 . . . . 0.0 113.52 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -62.0 -31.2 71.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.096 0.862 . . . . 0.0 110.491 170.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.2 mt -79.75 -41.93 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 124.461 1.105 . . . . 0.0 111.652 173.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 52.3 m -52.51 -42.3 64.2 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.694 1.588 . . . . 0.0 112.057 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -24.59 53.88 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -140.42 57.43 8.68 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.179 1.392 . . . . 0.0 112.781 -169.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -64.31 -23.95 65.34 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.383 2.055 . . . . 0.0 115.731 -166.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -95.15 -14.07 24.48 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.535 1.134 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -88.12 128.16 54.68 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 119.141 0.882 . . . . 0.0 112.675 -172.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -60.88 -22.79 75.26 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.641 2.227 . . . . 0.0 114.05 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.7 -30.77 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.4 1.48 . . . . 0.0 113.607 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -35.58 55.53 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.36 -1.462 . . . . 0.0 112.136 174.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -79.72 -33.85 40.54 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.572 1.149 . . . . 0.0 112.489 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.9 p -62.49 -31.08 71.77 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.223 -0.923 . . . . 0.0 112.24 169.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -77.23 -47.04 21.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.41 1.084 . . . . 0.0 111.607 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.766 ' HZ2' ' HD2' ' A' ' 28' ' ' ASP . 70.8 tttt -57.53 -35.56 70.45 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.879 1.672 . . . . 0.0 112.552 176.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.04 89.89 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 169.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 tpt -65.16 -43.25 92.39 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.636 1.175 . . . . 0.0 111.606 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.61 93.51 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.654 0.782 . . . . 0.0 112.368 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.9 mt -58.6 -41.32 85.55 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.217 0.607 . . . . 0.0 112.404 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.25 -33.14 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-N 118.961 0.8 . . . . 0.0 112.699 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -18.16 63.64 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.631 1.173 . . . . 0.0 113.197 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 tt -95.96 -39.6 9.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.345 2.258 . . . . 0.0 111.899 179.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 122.16 16.92 3.81 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.614 1.102 . . . . 0.0 115.715 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -103.02 48.4 0.86 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.746 1.619 . . . . 0.0 110.319 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -55.09 -38.1 67.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.665 1.586 . . . . 0.0 112.147 -174.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.6 m -65.97 -20.44 66.2 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 113.285 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -81.62 -40.26 23.23 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.874 -1.141 . . . . 0.0 110.978 169.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.95 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.5 pt -62.09 -33.04 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.742 0.701 . . . . 0.0 112.632 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.5 tm0? -75.83 -43.94 43.48 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.124 0.569 . . . . 0.0 111.669 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.9 tpp -54.76 -39.04 67.94 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.969 0.804 . . . . 0.0 112.568 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.36 -40.76 91.92 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.196 -0.94 . . . . 0.0 113.018 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -76.12 -28.48 57.48 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.27 1.028 . . . . 0.0 112.482 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -32.47 70.47 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.851 0.86 . . . . 0.0 112.245 166.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.57 -25.45 60.81 Favored Glycine 0 CA--C 1.536 1.364 0 O-C-N 120.321 -1.487 . . . . 0.0 113.942 174.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.86 -21.33 28.54 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.33 1.565 . . . . 0.0 112.958 166.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -72.31 4.23 3.9 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 125.556 1.542 . . . . 0.0 115.032 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -124.09 29.09 6.54 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.468 2.307 . . . . 0.0 111.947 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -127.0 12.12 7.16 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -163.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.1 p -71.55 -7.48 47.89 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -169.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.7 t -132.86 157.12 45.84 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.016 1.726 . . . . 0.0 112.135 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -48.65 -33.07 9.29 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.339 1.855 . . . . 0.0 112.84 173.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -55.94 -19.45 12.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.448 1.499 . . . . 0.0 114.065 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -131.79 17.07 4.73 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 112.453 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.5 p -71.96 -32.47 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 120.066 -1.646 . . . . 0.0 112.891 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.68 -35.32 70.24 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.239 -0.913 . . . . 0.0 111.405 171.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.1 mm -59.84 -37.37 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.988 1.715 . . . . 0.0 112.108 168.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -58.5 -33.61 70.01 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.401 1.0 . . . . 0.0 112.469 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -77.86 -41.59 36.29 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.699 0.8 . . . . 0.0 112.774 167.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -66.34 -16.99 64.5 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -92.83 -36.64 12.73 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.933 1.242 . . . . 0.0 114.051 161.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -73.1 -30.99 64.05 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.773 1.624 . . . . 0.0 113.727 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -31.17 63.89 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.592 1.087 . . . . 0.0 111.531 167.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.848 HH22 ' HE2' ' B' ' -2' ' ' GLU . 3.1 tpp180 -63.48 -34.13 77.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.121 -0.987 . . . . 0.0 111.807 174.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.74 -44.35 96.42 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.111 0.964 . . . . 0.0 112.079 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -68.7 -33.05 73.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.868 1.267 . . . . 0.0 111.943 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.36 -14.51 46.17 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 174.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.85 -46.27 65.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.905 1.684 . . . . 0.0 111.194 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -74.11 -6.49 47.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.75 -49.77 6.36 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.592 1.568 . . . . 0.0 113.66 162.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.89 -27.48 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.028 2.131 . . . . 0.0 113.69 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.76 -19.45 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.357 1.063 . . . . 0.0 112.569 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.96 -159.07 43.28 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 125.839 1.685 . . . . 0.0 113.765 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.5 m 60.82 27.73 17.52 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.993 1.317 . . . . 0.0 114.347 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.8 t -75.15 150.09 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 125.302 1.441 . . . . 0.0 112.396 -173.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -130.51 -179.86 5.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.718 2.007 . . . . 0.0 113.633 -175.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mt 55.31 57.35 10.85 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.551 2.34 . . . . 0.0 112.69 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.35 3.76 3.9 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.056 2.504 . . . . 0.0 114.52 -178.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.8 t 54.54 -143.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 125.115 1.366 . . . . 0.0 109.561 -164.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.2 t 55.49 51.4 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 126.124 1.77 . . . . 0.0 112.476 170.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 67.31 -53.75 0.48 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 128.387 2.675 . . . . 0.0 116.981 162.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 31.0 m -149.78 1.43 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.719 1.608 . . . . 0.0 113.597 -167.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -66.73 -34.1 77.11 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -157.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -151.23 -70.2 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.221 1.009 . . . . 0.0 109.185 159.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.8 mt 62.97 152.12 0.11 Allowed Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 127.952 2.501 . . . . 0.0 115.928 170.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.74 123.41 8.5 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.82 2.347 . . . . 0.0 111.28 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 50.15 23.64 1.21 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.832 2.053 . . . . 0.0 115.787 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.35 54.8 31.67 Favored Glycine 0 CA--C 1.531 1.051 0 O-C-N 120.897 -1.127 . . . . 0.0 113.035 -171.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -45.26 -41.72 8.85 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.956 2.103 . . . . 0.0 115.697 -173.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.35 4.7 52.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.803 1.183 . . . . 0.0 113.862 -171.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -61.28 151.98 30.37 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.041 -1.037 . . . . 0.0 111.169 167.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 C--O 1.255 1.353 0 C-N-CA 124.738 1.215 . . . . 0.0 113.042 -178.301 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.48 1.056 0 CA-C-O 118.871 -0.585 . . . . 0.0 111.994 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 50.1 49.48 20.33 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.711 1.204 . . . . 0.0 112.856 -174.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.848 ' HE2' HH22 ' A' ' 83' ' ' ARG . 14.8 tt0 -118.59 166.79 12.3 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.862 -1.149 . . . . 0.0 112.884 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 95.8 t -23.8 122.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 130.213 3.405 . . . . 0.0 114.044 172.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 35.8 t70 . . . . . 0 C--O 1.251 1.159 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -160.987 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 p -64.8 -37.03 86.24 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.73 -41.11 99.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.154 0.888 . . . . 0.0 111.349 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.15 -38.65 72.23 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.47 -0.769 . . . . 0.0 112.9 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.58 -24.51 64.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.277 1.031 . . . . 0.0 113.379 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -73.53 -63.0 1.29 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.592 1.157 . . . . 0.0 111.378 160.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -60.83 -30.62 70.2 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -163.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -65.55 -37.42 86.65 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.101 0.96 . . . . 0.0 112.942 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.757 ' HE2' ' H1 ' ' B' ' -4' ' ' MET . 32.2 mt-10 -92.41 -31.33 15.34 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.558 1.072 . . . . 0.0 112.122 178.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -49.37 -39.56 32.56 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.313 1.445 . . . . 0.0 111.674 166.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -52.77 -43.2 60.13 Favored Glycine 0 CA--C 1.537 1.444 0 O-C-N 121.435 -0.791 . . . . 0.0 113.972 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -70.51 -38.78 74.33 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.199 1.499 . . . . 0.0 111.956 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -63.72 -31.94 73.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.278 1.031 . . . . 0.0 112.502 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.83 -37.59 79.26 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.587 -1.321 . . . . 0.0 112.332 175.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.48 -32.61 73.53 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.422 1.01 . . . . 0.0 112.245 165.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.0 10.8 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.53 1.932 . . . . 0.0 114.947 174.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -120.54 -44.55 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.781 1.633 . . . . 0.0 110.732 165.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.69 -1.68 3.61 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.19 1.376 . . . . 0.0 114.821 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.0 mt -87.26 53.56 2.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.466 1.906 . . . . 0.0 111.244 -170.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -53.71 -35.93 61.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.012 1.325 . . . . 0.0 113.36 -173.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -75.21 -33.65 61.4 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.188 0.904 . . . . 0.0 112.176 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -75.44 -29.76 59.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.167 0.894 . . . . 0.0 112.248 168.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.7 -44.55 89.88 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.127 -0.983 . . . . 0.0 111.861 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.9 t -62.83 -42.01 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.928 0.891 . . . . 0.0 111.02 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -54.28 -40.37 67.78 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.63 0.65 . . . . 0.0 112.717 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.9 m -68.97 -38.85 79.63 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.952 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.18 -35.68 76.54 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.512 1.506 . . . . 0.0 111.361 172.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.61 -22.3 65.36 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.291 1.036 . . . . 0.0 112.582 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.87 -47.92 73.29 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.904 0.775 . . . . 0.0 111.391 167.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -36.76 76.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.123 0.874 . . . . 0.0 110.619 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 55.7 mt -74.55 -21.92 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.024 0.829 . . . . 0.0 112.277 177.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.2 m -79.18 -41.66 27.87 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.431 -1.418 . . . . 0.0 111.85 171.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.19 -25.16 29.74 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -137.99 63.95 39.55 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 125.475 1.51 . . . . 0.0 111.189 -175.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -64.07 -12.1 30.67 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.76 2.973 . . . . 0.0 118.567 -165.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -122.08 3.98 9.86 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.037 0.935 . . . . 0.0 112.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.0 123.34 82.15 Favored Pre-proline 0 CA--C 1.544 0.742 0 O-C-N 120.391 -1.443 . . . . 0.0 110.329 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -63.43 -11.34 25.34 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.364 2.043 . . . . 0.0 114.461 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -53.61 -36.2 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.034 0.834 . . . . 0.0 112.42 167.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.9 -50.86 16.86 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 121.485 -0.76 . . . . 0.0 112.351 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -61.65 -40.96 96.76 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.022 0.929 . . . . 0.0 112.587 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.6 p -70.24 -21.64 62.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.091 -1.006 . . . . 0.0 113.615 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.74 -46.27 19.29 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.684 0.794 . . . . 0.0 111.412 170.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.28 -41.35 84.15 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.969 0.907 . . . . 0.0 112.568 173.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.82 -32.0 70.24 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -68.93 -44.56 72.82 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.627 -0.67 . . . . 0.0 111.127 172.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.18 82.49 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.757 0.823 . . . . 0.0 112.818 177.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.09 -47.0 81.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.364 0.666 . . . . 0.0 111.582 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.59 -29.48 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.487 1.04 . . . . 0.0 112.991 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.21 0.23 33.35 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.33 12.32 7.01 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.636 1.974 . . . . 0.0 113.687 171.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.39 15.79 79.31 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.494 1.357 . . . . 0.0 116.494 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -91.9 44.47 1.17 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.827 1.651 . . . . 0.0 112.452 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.0 -37.3 68.95 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.36 1.064 . . . . 0.0 113.03 -175.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 62.4 m -62.46 -30.06 70.98 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.88 1.272 . . . . 0.0 112.52 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -87.38 -29.32 21.6 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.001 0.52 . . . . 0.0 111.149 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.29 -41.4 73.4 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.306 1.042 . . . . 0.0 113.059 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.8 pt -60.64 -34.45 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.138 0.881 . . . . 0.0 112.029 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -68.43 -51.49 43.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.587 0.755 . . . . 0.0 111.373 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.88 -29.29 70.49 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -66.65 -43.59 84.2 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.044 -1.035 . . . . 0.0 111.998 174.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -67.99 -36.95 80.87 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.724 0.693 . . . . 0.0 111.563 175.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.62 -32.88 73.04 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.3 -0.875 . . . . 0.0 112.845 168.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.09 -23.33 66.43 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.493 -1.38 . . . . 0.0 114.402 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.47 -20.02 65.94 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.499 1.65 . . . . 0.0 112.944 171.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -65.92 -5.45 9.34 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.529 1.532 . . . . 0.0 114.58 169.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -122.37 50.25 1.5 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.913 2.085 . . . . 0.0 110.664 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -136.17 4.27 2.94 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -67.09 -29.98 69.9 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -164.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.2 p -113.1 166.27 11.58 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.115 1.366 . . . . 0.0 112.668 -169.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.01 -30.83 64.53 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.06 16.42 0.16 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -133.18 10.26 4.14 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.485 1.514 . . . . 0.0 113.577 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.4 m -63.77 -30.26 49.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 O-C-N 120.503 -1.373 . . . . 0.0 114.123 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.9 -37.23 24.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.734 0.697 . . . . 0.0 111.24 173.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -55.29 -43.98 73.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.336 1.055 . . . . 0.0 111.293 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 49.8 ttp85 -60.32 -40.12 89.45 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.082 0.953 . . . . 0.0 112.046 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -66.75 -46.54 75.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.04 0.936 . . . . 0.0 112.678 170.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -51.73 -57.52 9.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.171 0.896 . . . . 0.0 111.394 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -67.22 -28.24 67.91 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.825 1.193 . . . . 0.0 113.562 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -74.3 -45.89 44.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.848 1.204 . . . . 0.0 112.81 174.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -33.21 73.06 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.039 1.29 . . . . 0.0 111.646 176.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.618 HH22 ' HE2' ' B' ' -2' ' ' GLU . 23.9 mmt-85 -55.65 -36.96 67.61 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.42 1.009 . . . . 0.0 112.064 171.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 20.1 tp -70.01 -44.14 69.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.142 0.883 . . . . 0.0 111.92 178.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -63.96 -30.29 71.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.047 0.939 . . . . 0.0 112.983 172.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.89 -20.22 23.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.56 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.778 1.626 . . . . 0.0 110.327 168.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -69.56 -16.67 63.46 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 171.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.71 -52.22 7.39 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 125.627 1.584 . . . . 0.0 113.382 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.4 -36.41 66.02 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.598 1.559 . . . . 0.0 112.444 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.26 -31.72 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.353 0.661 . . . . 0.0 112.212 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 62.47 -95.77 0.13 Allowed Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.431 1.015 . . . . 0.0 113.096 -175.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m -62.68 151.38 38.44 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.092 1.757 . . . . 0.0 114.83 -168.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -75.77 35.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 126.244 1.818 . . . . 0.0 113.148 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 -1.19 56.73 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.398 1.879 . . . . 0.0 113.879 -165.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.7 mp -127.72 79.82 72.96 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.471 1.509 . . . . 0.0 109.274 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -89.13 -11.2 3.75 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.489 2.793 . . . . 0.0 113.425 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.5 t 56.45 34.55 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 126.654 1.982 . . . . 0.0 114.144 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 40.9 t -140.44 108.46 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.818 1.247 . . . . 0.0 111.862 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 48.4 -107.3 0.21 Allowed 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.822 2.156 . . . . 0.0 116.822 162.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.2 t -142.74 117.43 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 125.507 1.523 . . . . 0.0 111.537 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -165.82 -77.5 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.477 1.911 . . . . 0.0 109.304 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -147.46 112.98 5.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.523 2.329 . . . . 0.0 107.489 165.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 mp -143.08 167.13 16.8 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.808 2.043 . . . . 0.0 111.31 -168.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -54.6 160.87 6.53 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.421 2.748 . . . . 0.0 114.573 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -58.0 144.45 39.61 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.128 1.371 . . . . 0.0 111.914 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.62 -14.98 0.67 Allowed Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.605 1.402 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -67.51 121.19 15.29 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.785 1.793 . . . . 0.0 110.572 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 t70 60.93 10.44 2.78 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.716 2.006 . . . . 0.0 115.115 -170.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.39 141.84 48.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.364 1.466 . . . . 0.0 112.342 -168.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.251 1.139 0 C-N-CA 126.695 1.998 . . . . 0.0 113.922 -173.406 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.757 ' H1 ' ' HE2' ' A' ' 9' ' ' GLU . 21.1 mmt . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 121.327 0.584 . . . . 0.0 109.633 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -134.21 38.13 3.15 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.706 1.202 . . . . 0.0 112.241 172.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.618 ' HE2' HH22 ' A' ' 83' ' ' ARG . 87.1 mt-10 -75.62 41.43 0.2 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.555 1.542 . . . . 0.0 113.139 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 12.1 p -73.47 -28.61 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -161.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.783 1.633 . . . . 0.0 113.625 -175.8 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 37.1 mtt . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.1 m -57.62 -36.88 72.39 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -63.6 -20.16 65.43 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.731 -1.231 . . . . 0.0 113.588 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -15.49 49.33 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.683 ' HE2' ' HA ' ' B' ' -4' ' ' MET . 5.5 mm-40 -74.17 -52.19 13.24 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 157.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.08 -39.8 60.27 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.265 1.026 . . . . 0.0 112.5 -176.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -72.27 -28.34 63.05 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -81.79 -34.65 30.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.218 1.372 . . . . 0.0 112.708 173.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -75.94 -41.06 52.77 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.123 0.969 . . . . 0.0 111.222 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -59.82 -39.4 84.93 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.867 0.867 . . . . 0.0 111.275 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.18 -50.62 51.11 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-N 119.108 0.867 . . . . 0.0 112.477 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -66.24 -40.81 90.5 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.315 1.057 . . . . 0.0 111.601 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 t -57.52 -43.11 84.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.421 1.088 . . . . 0.0 112.668 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.7 mt -67.2 -35.61 79.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.92 1.288 . . . . 0.0 112.142 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -70.3 -28.13 64.94 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 172.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.468 ' HZ3' ' HD2' ' B' ' 0' ' ' ASP . 1.0 OUTLIER -72.86 -14.34 61.47 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.283 1.033 . . . . 0.0 112.79 171.16 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -98.63 -53.87 3.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.873 1.269 . . . . 0.0 112.793 176.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.65 14.95 0.99 Allowed Glycine 0 CA--C 1.537 1.46 0 N-CA-C 115.364 0.906 . . . . 0.0 115.364 -172.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.0 mt -101.61 58.01 0.85 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.285 1.834 . . . . 0.0 110.21 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.99 -36.82 85.24 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.8 1.24 . . . . 0.0 113.499 -168.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.63 -33.19 27.95 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.227 0.921 . . . . 0.0 111.279 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -63.49 -39.99 95.89 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.15 0.432 . . . . 0.0 110.558 167.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.55 -45.88 77.95 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.491 -0.755 . . . . 0.0 112.757 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.06 -35.43 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.199 173.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -61.12 -44.75 96.85 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.857 1.208 . . . . 0.0 112.166 172.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.0 m -60.14 -39.94 88.11 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.841 0.856 . . . . 0.0 112.674 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -75.0 -38.14 61.68 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 175.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -62.49 -32.21 73.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.264 0.938 . . . . 0.0 111.452 172.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -69.36 -26.73 64.82 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 174.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.49 -42.6 78.59 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.988 1.267 . . . . 0.0 110.552 166.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.6 mt -80.93 -21.39 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.022 1.329 . . . . 0.0 111.642 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.1 m -66.29 -44.38 83.67 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.241 -1.537 . . . . 0.0 110.735 168.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.77 -19.9 31.88 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.867 1.267 . . . . 0.0 114.355 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -141.45 68.6 26.05 Favored Pre-proline 0 CA--C 1.556 1.181 0 C-N-CA 125.49 1.516 . . . . 0.0 111.143 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -67.18 -22.01 47.55 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.866 2.378 . . . . 0.0 117.037 -167.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.2 tp60 -100.18 -27.12 13.68 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.616 1.166 . . . . 0.0 111.794 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -69.51 138.18 88.68 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 123.865 0.866 . . . . 0.0 112.872 -171.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.28 -20.83 62.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.909 2.406 . . . . 0.0 113.935 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -46.22 -59.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 125.244 1.418 . . . . 0.0 112.222 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.51 -34.86 85.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 118.95 -0.917 . . . . 0.0 113.432 -172.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -62.62 -42.4 99.57 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.897 1.349 . . . . 0.0 111.285 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.7 p -67.06 -25.44 66.25 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.879 HD21 ' HE2' ' B' ' -2' ' ' GLU . 33.4 m120 -85.19 -38.82 18.53 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.931 0.892 . . . . 0.0 112.056 172.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -63.32 -31.29 72.4 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.1 -1.625 . . . . 0.0 112.173 173.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.26 -38.61 84.04 Favored 'General case' 0 CA--C 1.548 0.904 0 O-C-N 121.007 -1.058 . . . . 0.0 113.364 169.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -64.12 -43.46 95.2 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.74 0.816 . . . . 0.0 111.17 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.96 79.43 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.334 0.654 . . . . 0.0 111.878 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.75 -38.93 92.49 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.503 -0.748 . . . . 0.0 112.751 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.4 pt -75.79 -25.86 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 CA-C-N 120.111 1.323 . . . . 0.0 113.831 174.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -19.96 39.11 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.913 1.285 . . . . 0.0 113.143 175.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 tt -80.41 -43.52 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.687 1.595 . . . . 0.0 109.854 165.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.79 32.36 4.47 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.242 0.925 . . . . 0.0 113.802 -175.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -101.71 57.42 0.83 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.761 1.624 . . . . 0.0 109.232 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -59.33 -35.05 73.11 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.494 -0.754 . . . . 0.0 111.917 -170.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 88.4 m -62.08 -29.91 70.64 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.114 0.966 . . . . 0.0 112.785 174.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -81.57 -34.54 31.01 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 111.453 171.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.36 98.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.24 -0.913 . . . . 0.0 112.881 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.9 pt -64.33 -30.44 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.299 0.639 . . . . 0.0 112.681 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -71.08 -51.21 26.52 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.475 0.71 . . . . 0.0 110.767 170.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.6 ttm -63.51 -34.04 76.9 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -175.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.3 m -69.76 -42.64 73.58 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.17 -0.956 . . . . 0.0 112.053 175.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.17 -37.16 80.68 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.011 0.823 . . . . 0.0 112.078 177.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -39.92 92.53 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.332 1.053 . . . . 0.0 111.867 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.41 -23.92 77.49 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.229 -1.544 . . . . 0.0 114.233 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.2 mt -66.93 -25.75 66.51 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.959 1.379 . . . . 0.0 112.348 169.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.78 -48.34 82.06 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.142 0.883 . . . . 0.0 111.24 170.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -64.24 -28.1 69.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.255 1.022 . . . . 0.0 113.351 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.5 p -118.64 -1.4 11.15 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -158.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -78.68 49.79 0.92 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.579 1.152 . . . . 0.0 112.825 177.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 t -157.46 153.46 27.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.622 1.569 . . . . 0.0 112.025 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.06 -35.59 25.8 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -164.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.52 -2.82 47.67 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -133.62 12.26 4.08 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.957 1.703 . . . . 0.0 113.098 -173.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.49 -24.86 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.74 -37.22 59.53 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.427 1.012 . . . . 0.0 111.133 171.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mm -65.6 -33.86 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.284 1.033 . . . . 0.0 111.186 173.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -57.41 -44.5 84.65 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.909 1.284 . . . . 0.0 111.401 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 m -66.55 -34.5 78.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.923 0.889 . . . . 0.0 112.56 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -68.9 -0.6 5.75 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 170.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.98 -33.39 6.93 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 117.522 -1.228 . . . . 0.0 113.405 156.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -54.6 -54.64 38.69 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.238 1.835 . . . . 0.0 112.092 173.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -30.17 67.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 122.08 -0.388 . . . . 0.0 111.452 -172.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -64.83 -40.3 94.96 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.35 -0.844 . . . . 0.0 111.563 170.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.57 -30.75 68.61 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.968 0.907 . . . . 0.0 112.159 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -68.69 -47.45 66.41 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.006 0.523 . . . . 0.0 112.063 165.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.88 -16.09 62.67 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.095 -1.003 . . . . 0.0 113.694 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.46 93.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.437 1.471 . . . . 0.0 111.327 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.58 -27.47 65.14 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 121.47 0.652 . . . . 0.0 112.038 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.67 -47.15 42.61 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.349 1.452 . . . . 0.0 112.782 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.17 -32.68 44.3 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.02 1.728 . . . . 0.0 113.218 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.9 p -71.41 -33.2 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.953 0.797 . . . . 0.0 111.112 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.4 21.44 4.37 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.484 1.516 . . . . 0.0 114.661 171.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.4 m -125.73 20.74 7.77 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.342 1.457 . . . . 0.0 113.582 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.8 m -90.72 142.35 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.863 0.865 . . . . 0.0 112.097 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -109.75 177.89 4.59 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.681 1.592 . . . . 0.0 112.714 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 13.1 mt 66.93 86.86 0.12 Allowed Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 126.796 2.038 . . . . 0.0 110.189 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -71.41 -15.97 31.06 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.185 1.923 . . . . 0.0 113.413 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 t 65.46 46.56 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 125.276 1.43 . . . . 0.0 112.023 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 28.8 m -133.61 170.78 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.908 1.283 . . . . 0.0 112.12 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -78.82 -36.16 43.0 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.681 0.792 . . . . 0.0 112.536 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -138.47 125.73 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 122.034 0.921 . . . . 0.0 112.882 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.69 -135.37 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.978 2.511 . . . . 0.0 106.545 160.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -87.53 -39.52 15.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.354 1.434 . . . . 0.0 111.103 171.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.8 mt 62.4 143.03 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 129.46 3.104 . . . . 0.0 114.856 166.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.94 122.94 6.02 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.69 2.26 . . . . 0.0 111.644 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 46.29 42.07 9.84 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.068 1.347 . . . . 0.0 112.767 -174.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.77 -43.2 2.57 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.821 1.677 . . . . 0.0 116.013 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 56.0 t80 59.16 -41.45 0.07 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 128.433 2.693 . . . . 0.0 117.055 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -133.29 121.16 22.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.902 2.081 . . . . 0.0 110.073 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mmt-85 -143.81 154.82 43.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.807 1.643 . . . . 0.0 110.988 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 72.5 m . . . . . 0 C--O 1.247 0.961 0 C-N-CA 126.127 1.771 . . . . 0.0 111.973 176.663 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.683 ' HA ' ' HE2' ' A' ' 5' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.13 166.86 11.2 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.872 2.069 . . . . 0.0 114.318 -167.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.879 ' HE2' HD21 ' A' ' 43' ' ' ASN . 0.0 OUTLIER -134.62 154.0 51.71 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.355 1.862 . . . . 0.0 110.674 163.535 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.98 139.13 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.063 -1.023 . . . . 0.0 113.55 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . 0.468 ' HD2' ' HZ3' ' A' ' 16' ' ' LYS . 4.4 t70 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.642 2.377 . . . . 0.0 110.214 172.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.754 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.9 p -121.78 -16.39 7.67 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -173.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -64.0 -30.5 71.57 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 121.409 1.913 . . . . 0.0 112.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -13.2 59.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 174.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -77.81 -48.33 16.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 120.96 -1.087 . . . . 0.0 108.636 163.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -46.74 65.04 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.256 1.022 . . . . 0.0 111.974 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -66.92 -25.96 66.62 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.5 ptpp? -86.95 -30.97 20.91 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.987 1.267 . . . . 0.0 113.589 174.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -76.92 -31.85 56.95 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.968 0.803 . . . . 0.0 111.185 173.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -57.66 -52.62 64.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.624 1.57 . . . . 0.0 110.776 159.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.13 -45.97 71.59 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.175 0.898 . . . . 0.0 113.746 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -52.09 66.47 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.936 1.294 . . . . 0.0 111.479 173.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.4 m -60.15 -47.88 84.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.9 0.88 . . . . 0.0 111.379 -178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -55.71 -35.65 66.32 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.727 1.211 . . . . 0.0 112.044 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -66.48 -41.66 88.64 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 120.069 1.304 . . . . 0.0 113.997 173.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -42.19 99.37 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 119.262 0.937 . . . . 0.0 111.833 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -72.35 -25.16 61.43 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.85 12.88 15.08 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.263 1.411 . . . . 0.0 116.055 171.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.2 mt -97.81 61.8 1.59 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.93 2.092 . . . . 0.0 111.047 -174.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -59.26 -30.52 68.35 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.642 1.177 . . . . 0.0 113.986 -175.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -84.31 -32.24 24.44 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.015 -1.053 . . . . 0.0 111.463 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -65.61 -42.79 91.21 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.821 164.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.08 -48.49 70.8 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.479 -0.763 . . . . 0.0 112.405 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 49.6 t -60.34 -33.48 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.574 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -59.68 -43.69 93.9 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.026 1.285 . . . . 0.0 112.592 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.3 m -70.3 -34.03 72.24 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.721 -0.612 . . . . 0.0 112.313 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -72.89 -40.2 65.75 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.877 0.871 . . . . 0.0 112.901 172.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -58.76 -36.06 73.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.546 1.138 . . . . 0.0 111.263 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.33 -14.45 60.1 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.67 -39.98 95.68 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.13 1.332 . . . . 0.0 110.251 161.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.9 mt -75.56 -44.59 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 m -60.1 -33.47 72.15 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.771 1.169 . . . . 0.0 112.286 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.39 -22.09 44.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -144.55 61.12 8.28 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.085 1.354 . . . . 0.0 111.802 -170.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -64.99 -20.52 64.05 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.353 2.035 . . . . 0.0 117.164 -158.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -113.27 3.26 15.88 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.074 0.95 . . . . 0.0 112.237 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -82.01 127.12 73.11 Favored Pre-proline 0 CA--C 1.541 0.608 0 O-C-N 120.717 -1.239 . . . . 0.0 111.613 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.39 -14.79 44.38 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 122.347 2.031 . . . . 0.0 113.806 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.58 -36.98 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-N 119.739 1.154 . . . . 0.0 112.287 170.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.38 -50.16 28.22 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 121.099 -1.0 . . . . 0.0 111.717 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -66.73 -38.56 86.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.303 1.041 . . . . 0.0 112.967 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.7 p -69.58 -14.46 62.85 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 173.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -91.81 -41.4 10.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.276 1.031 . . . . 0.0 111.946 168.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.37 -36.77 83.3 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.793 -1.192 . . . . 0.0 112.396 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.76 -35.3 76.05 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.327 -0.858 . . . . 0.0 113.021 170.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.6 tpt -68.85 -41.87 77.88 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.828 0.851 . . . . 0.0 111.657 175.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -46.11 84.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.746 0.819 . . . . 0.0 111.286 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.6 mt -59.57 -35.82 75.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.66 0.784 . . . . 0.0 112.951 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.5 pt -84.07 -17.78 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.01 -14.92 53.05 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.674 1.19 . . . . 0.0 112.429 168.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.5 tt -94.3 -50.61 5.18 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.924 2.489 . . . . 0.0 111.579 175.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.88 15.95 2.51 Favored Glycine 0 CA--C 1.54 1.646 0 N-CA-C 116.4 1.32 . . . . 0.0 116.4 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -105.31 53.69 0.71 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.413 1.485 . . . . 0.0 110.002 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.87 -29.55 69.61 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.032 -1.042 . . . . 0.0 112.998 -173.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.5 m -60.74 -29.8 69.6 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.953 0.797 . . . . 0.0 111.912 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -76.36 -36.33 58.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.106 0.562 . . . . 0.0 111.445 172.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.32 -37.93 74.83 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.8 pt -65.08 -33.32 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.896 0.771 . . . . 0.0 111.973 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.0 tm0? -68.6 -45.8 71.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.45 0.7 . . . . 0.0 110.818 171.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.9 ttm -73.77 -31.2 63.18 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -173.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.9 m -66.76 -39.91 88.04 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.907 -1.121 . . . . 0.0 111.464 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -67.48 -37.66 83.23 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.442 -0.786 . . . . 0.0 112.008 173.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.32 -31.93 72.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.284 0.634 . . . . 0.0 111.989 171.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.93 -24.56 64.06 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 120.241 1.382 . . . . 0.0 114.391 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.4 mt -62.3 -22.16 65.82 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.648 1.724 . . . . 0.0 112.253 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.68 -2.44 2.45 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 169.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -120.81 40.59 3.5 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.052 1.741 . . . . 0.0 111.665 -175.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 34.3 p -135.9 7.44 3.21 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 116.857 2.169 . . . . 0.0 116.857 -164.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 95.3 p -83.38 19.05 1.62 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -172.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -142.81 144.62 32.63 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.609 1.964 . . . . 0.0 109.61 177.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.79 -9.79 31.65 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.031 0.932 . . . . 0.0 113.465 176.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -59.12 -23.69 62.34 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.399 1.08 . . . . 0.0 112.309 164.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -129.92 24.22 5.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.937 2.095 . . . . 0.0 112.675 -176.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.06 -34.46 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 O-C-N 119.958 -1.714 . . . . 0.0 111.996 173.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.0 79.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.521 -0.737 . . . . 0.0 111.44 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.1 mm -65.13 -37.11 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.43 1.092 . . . . 0.0 111.184 170.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -59.57 -40.21 86.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.702 0.801 . . . . 0.0 111.997 177.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.6 t -70.04 -46.49 64.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.218 1.007 . . . . 0.0 112.162 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.803 ' HZ2' ' HE2' ' B' ' -2' ' ' GLU . 29.6 ttpt -72.05 -3.95 25.94 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -175.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -101.58 -33.13 10.04 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.064 1.302 . . . . 0.0 113.705 158.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -67.75 -49.71 61.04 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 120.381 1.446 . . . . 0.0 112.723 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -34.17 77.31 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.878 1.217 . . . . 0.0 111.19 174.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -65.04 -31.65 72.99 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.86 -1.15 . . . . 0.0 112.116 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.9 tp -71.63 -37.96 70.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.299 1.04 . . . . 0.0 112.774 169.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.03 -36.92 83.05 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.757 -0.589 . . . . 0.0 111.438 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.56 -25.49 35.8 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.889 -1.132 . . . . 0.0 113.259 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.72 99.89 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.47 1.486 . . . . 0.0 111.408 167.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -64.63 -27.18 68.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.801 0.84 . . . . 0.0 112.211 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.52 -46.04 57.09 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 125.688 1.613 . . . . 0.0 113.605 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.64 -28.79 61.02 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.6 1.16 . . . . 0.0 113.094 -177.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.7 p -80.44 -24.32 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -94.79 -157.76 32.79 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 124.177 0.894 . . . . 0.0 112.602 171.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -136.42 145.98 45.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.871 0.868 . . . . 0.0 112.849 165.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 1.3 t 46.22 37.8 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 126.79 2.036 . . . . 0.0 112.949 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -70.21 115.71 9.72 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.969 1.308 . . . . 0.0 110.525 -171.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.477 ' H ' ' HD3' ' A' ' 105' ' ' PRO . 4.0 mp 56.54 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.141 1.776 . . . . 0.0 109.567 -155.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -79.13 -4.19 13.66 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.883 3.055 . . . . 0.0 112.551 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 t 64.53 45.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.476 1.11 . . . . 0.0 111.826 172.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 17.2 m -140.13 44.25 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.168 2.187 . . . . 0.0 111.059 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 50.07 -136.19 1.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.91 1.284 . . . . 0.0 112.032 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 33.6 m -87.63 6.95 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 -168.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -51.14 -40.85 59.47 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.484 1.514 . . . . 0.0 114.191 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -135.84 -58.58 0.76 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.864 1.266 . . . . 0.0 112.554 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.4 mt 50.89 163.21 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 128.514 2.726 . . . . 0.0 117.84 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.477 ' HD3' ' H ' ' A' ' 96' ' ' ILE . 68.4 Cg_endo -88.27 -20.9 1.66 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 124.241 3.294 . . . . 0.0 115.236 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -152.31 170.81 19.13 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.832 1.253 . . . . 0.0 111.854 -162.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.8 56.69 0.15 Allowed Glycine 0 CA--C 1.539 1.56 0 C-N-CA 126.316 1.912 . . . . 0.0 113.567 164.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -98.36 175.56 6.01 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.8 2.44 . . . . 0.0 112.171 -169.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.35 45.2 23.28 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.434 1.094 . . . . 0.0 113.338 175.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -75.84 49.6 0.53 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.805 2.042 . . . . 0.0 113.874 -173.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--O 1.253 1.262 0 C-N-CA 127.766 2.427 . . . . 0.0 113.217 -173.357 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.537 ' H1 ' ' HE2' ' B' ' -3' ' ' GLU . 25.0 mmt . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . 0.537 ' HE2' ' H1 ' ' B' ' -4' ' ' MET . 5.3 mp0 -112.02 158.31 19.69 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.006 0.922 . . . . 0.0 113.14 -173.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.803 ' HE2' ' HZ2' ' A' ' 79' ' ' LYS . 0.8 OUTLIER -142.49 -3.98 1.01 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -156.027 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 45.4 t -144.73 132.08 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.902 1.281 . . . . 0.0 109.704 -174.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 3.7 p30 . . . . . 0 C--O 1.251 1.148 0 C-N-CA 125.098 1.359 . . . . 0.0 113.357 167.359 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.6 mtt . . . . . 0 N--CA 1.477 0.911 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -48.96 -45.59 42.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.0 1.72 . . . . 0.0 114.416 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -69.51 -36.5 76.52 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.548 0.739 . . . . 0.0 110.7 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -63.7 -37.22 86.53 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.425 -0.797 . . . . 0.0 112.835 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -72.21 -17.76 61.9 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.18 -28.32 16.35 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.3 -36.23 68.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.471 1.032 . . . . 0.0 112.512 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -60.1 -33.67 72.43 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.072 0.851 . . . . 0.0 111.344 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.62 -34.02 62.7 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.678 0.791 . . . . 0.0 113.041 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -64.74 -42.83 94.88 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.316 -0.865 . . . . 0.0 111.435 168.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.87 -41.83 99.39 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 121.669 -0.644 . . . . 0.0 112.482 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -58.74 -38.43 78.39 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.784 -0.833 . . . . 0.0 112.544 172.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -68.83 -42.46 77.17 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.683 0.674 . . . . 0.0 111.901 175.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -56.76 -40.45 75.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.868 1.213 . . . . 0.0 112.438 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -58.14 -39.07 77.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.857 0.753 . . . . 0.0 112.322 171.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.56 65.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -84.86 4.46 33.13 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.226 0.921 . . . . 0.0 113.157 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.75 4.57 90.01 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-O 119.142 -0.81 . . . . 0.0 114.151 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.8 mt -84.62 54.04 2.89 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.313 1.557 . . . . 0.0 111.622 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -57.35 -32.25 66.56 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.897 1.279 . . . . 0.0 113.306 -173.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -83.59 -23.95 31.71 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.336 1.426 . . . . 0.0 113.039 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -75.76 -36.8 59.75 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.277 0.944 . . . . 0.0 111.21 164.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.76 -38.1 58.66 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.0 t -64.88 -35.56 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 O-C-N 120.626 -1.296 . . . . 0.0 110.885 170.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -59.88 -33.36 71.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.032 0.833 . . . . 0.0 112.267 171.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.6 m -64.64 -36.19 83.46 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.465 173.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.336 0.2 OUTLIER -66.11 -29.82 70.2 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.491 1.496 . . . . 0.0 114.249 -178.826 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.59 -36.12 80.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.317 0.962 . . . . 0.0 112.096 172.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -61.62 -34.15 75.15 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.763 0.711 . . . . 0.0 112.659 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.41 -37.08 85.88 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 121.711 -0.618 . . . . 0.0 110.873 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.7 mt -82.18 -35.81 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 110.444 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.8 m -63.37 -31.66 72.88 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.4 1.454 . . . . 0.0 112.628 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.13 -29.37 57.79 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 169.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -134.65 61.81 50.59 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 124.838 1.255 . . . . 0.0 112.286 -169.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -64.04 -25.4 66.27 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.601 2.201 . . . . 0.0 117.279 -160.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -120.06 23.34 11.05 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.538 1.135 . . . . 0.0 111.728 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -106.44 123.29 39.28 Favored Pre-proline 0 CA--C 1.544 0.734 0 O-C-N 121.182 -0.949 . . . . 0.0 112.824 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.401 ' HA ' ' CD2' ' A' ' 41' ' ' TYR . 19.0 Cg_endo -59.97 -13.64 24.03 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.116 2.544 . . . . 0.0 115.983 174.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.16 -37.77 57.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 120.262 1.392 . . . . 0.0 112.663 166.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.17 -44.49 60.04 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.647 0.658 . . . . 0.0 111.573 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.401 ' CD2' ' HA ' ' A' ' 38' ' ' PRO . 3.4 m-30 -65.32 -37.73 88.0 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.874 -0.78 . . . . 0.0 111.628 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 37.3 m -59.99 -37.55 80.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.455 1.102 . . . . 0.0 111.884 171.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.897 HD22 ' HE2' ' B' ' -2' ' ' GLU . 12.0 m-80 -81.47 -24.99 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.84 -40.82 92.1 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.971 -1.081 . . . . 0.0 111.614 163.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.25 -38.95 93.15 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.107 0.867 . . . . 0.0 112.596 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.1 tpt -60.41 -43.11 97.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.635 1.174 . . . . 0.0 112.043 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.21 -44.05 95.46 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.561 1.073 . . . . 0.0 112.417 172.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.5 mt -61.39 -44.57 96.92 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.536 0.734 . . . . 0.0 112.419 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -70.27 -29.0 37.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 119.432 1.014 . . . . 0.0 112.716 175.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -10.76 59.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -7.06 23.41 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.798 2.039 . . . . 0.0 112.55 167.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.21 14.21 75.01 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.7 1.143 . . . . 0.0 115.767 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -90.15 51.16 1.98 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.389 1.476 . . . . 0.0 110.769 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -55.35 -37.4 67.44 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.086 1.354 . . . . 0.0 112.467 -173.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.4 m -65.03 -22.84 67.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.993 1.317 . . . . 0.0 113.546 177.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -81.23 -39.5 25.26 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 110.769 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -37.41 87.04 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.596 -0.69 . . . . 0.0 112.707 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.0 pt -63.07 -33.17 59.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 113.127 177.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -72.68 -47.9 43.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.626 0.648 . . . . 0.0 110.969 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 29.0 ttm -63.58 -31.88 73.18 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 82.9 m -69.18 -39.93 78.42 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.121 -0.987 . . . . 0.0 111.798 174.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -69.4 -36.26 76.58 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.449 -0.782 . . . . 0.0 111.256 174.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -30.74 69.06 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.724 -1.235 . . . . 0.0 112.701 167.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.18 -31.69 54.38 Favored Glycine 0 N--CA 1.47 0.913 0 CA-C-N 120.612 1.551 . . . . 0.0 113.573 171.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.54 -28.92 70.27 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.34 1.57 . . . . 0.0 112.325 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -58.3 -16.04 12.65 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -88.65 2.8 52.55 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.223 1.409 . . . . 0.0 113.424 173.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -114.27 80.27 1.37 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -167.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.1 m -134.64 7.07 3.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.943 1.297 . . . . 0.0 114.151 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -143.02 161.13 38.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.389 1.475 . . . . 0.0 112.197 -173.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.0 -5.92 29.79 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -164.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.25 9.71 42.35 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 120.581 -1.324 . . . . 0.0 114.419 173.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -135.96 11.33 3.35 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.1 m -70.13 -35.57 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 120.183 -1.573 . . . . 0.0 114.236 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.47 -29.39 46.8 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.975 -1.078 . . . . 0.0 111.457 171.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.5 mm -58.33 -35.03 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 121.515 -0.741 . . . . 0.0 111.447 165.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttt-85 -57.39 -46.74 83.12 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.441 1.019 . . . . 0.0 110.715 173.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 75.3 m -64.69 -37.31 87.13 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.407 1.083 . . . . 0.0 113.591 171.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -57.18 -48.99 77.37 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.275 0.943 . . . . 0.0 110.842 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.93 -25.59 56.11 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 117.303 -1.332 . . . . 0.0 113.775 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -58.06 -53.8 54.16 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 120.855 1.662 . . . . 0.0 110.41 166.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.586 ' HH ' ' HD2' ' B' ' 0' ' ' ASP . 0.0 OUTLIER -75.1 -30.03 60.78 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -174.252 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.737 HH22 ' HD2' ' B' ' 0' ' ' ASP . 6.7 mmt-85 -58.42 -37.42 75.33 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.812 1.187 . . . . 0.0 112.103 169.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.92 -39.99 69.08 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.827 0.739 . . . . 0.0 112.098 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -58.02 -39.88 79.45 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.548 -0.72 . . . . 0.0 112.167 169.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.2 -19.46 33.98 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 120.965 -1.084 . . . . 0.0 113.771 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.42 -37.54 77.49 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.488 1.495 . . . . 0.0 111.373 164.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -69.11 -29.4 67.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.951 0.9 . . . . 0.0 111.826 169.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -55.3 13.84 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 126.374 1.94 . . . . 0.0 112.107 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.65 -27.72 65.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.123 1.369 . . . . 0.0 113.637 -174.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p -74.97 -24.52 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 CA-C-N 119.056 0.844 . . . . 0.0 112.61 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.83 -168.53 54.08 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.904 1.24 . . . . 0.0 115.917 170.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.9 t -148.6 173.0 13.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.601 1.56 . . . . 0.0 113.165 -174.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.8 t -67.82 -25.91 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.405 1.082 . . . . 0.0 111.351 161.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -79.07 172.44 13.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.339 1.056 . . . . 0.0 112.933 170.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 mt 54.3 77.02 0.46 Allowed Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 127.41 2.284 . . . . 0.0 110.718 -176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -82.22 -13.48 10.03 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.235 1.956 . . . . 0.0 112.55 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 t 55.3 56.2 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.348 1.859 . . . . 0.0 111.787 -170.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.09 125.83 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.771 1.629 . . . . 0.0 109.089 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 41.53 -122.6 0.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.313 1.845 . . . . 0.0 113.509 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 15.9 m -139.53 -27.87 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.495 1.518 . . . . 0.0 114.066 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.847 1.203 . . . . 0.0 114.234 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -92.47 8.62 37.92 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.996 -1.065 . . . . 0.0 113.206 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.0 mt -116.53 150.18 45.08 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 126.302 1.841 . . . . 0.0 111.724 -173.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -83.18 162.8 15.35 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 124.038 3.158 . . . . 0.0 113.62 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -69.04 145.36 53.58 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 122.223 1.011 . . . . 0.0 112.064 176.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.68 -38.27 3.16 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 125.175 1.369 . . . . 0.0 111.004 -157.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -92.82 -58.4 2.35 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.448 1.124 . . . . 0.0 111.589 173.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -152.25 147.44 26.38 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.129 0.972 . . . . 0.0 110.893 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 37.4 ttp180 -142.26 143.91 33.07 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.874 0.87 . . . . 0.0 111.439 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 C--O 1.252 1.223 0 C-N-CA 124.875 1.27 . . . . 0.0 114.163 -169.728 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -64.32 148.49 50.2 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.39 1.45 . . . . 0.0 114.368 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.897 ' HE2' HD22 ' A' ' 43' ' ' ASN . 58.6 mt-10 -126.54 164.94 20.08 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.906 1.683 . . . . 0.0 111.594 -179.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.6 -13.86 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 117.605 2.446 . . . . 0.0 117.605 -166.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . 0.737 ' HD2' HH22 ' A' ' 83' ' ' ARG . 1.2 m-20 . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 118.687 2.847 . . . . 0.0 118.687 169.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ptm . . . . . 0 N--CA 1.476 0.871 0 CA-C-O 118.993 -0.527 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -57.67 -32.3 67.19 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -164.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -62.03 -44.31 96.98 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.493 1.497 . . . . 0.0 111.433 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -40.91 91.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.358 1.063 . . . . 0.0 111.358 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.663 ' HE2' ' HZ3' ' A' ' 8' ' ' LYS . 24.2 mm-40 -61.2 -25.44 67.04 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.172 1.389 . . . . 0.0 113.161 171.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.7 -47.62 18.7 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.129 0.972 . . . . 0.0 111.49 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.66 -31.7 68.72 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.663 ' HZ3' ' HE2' ' A' ' 5' ' ' GLU . 16.5 ptpt -58.58 -35.02 71.73 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.298 0.954 . . . . 0.0 112.991 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.56 -21.25 20.19 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.68 -42.12 98.5 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.561 171.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.84 -36.96 91.73 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-O 119.218 -0.768 . . . . 0.0 114.224 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -57.15 -46.34 82.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.857 1.329 . . . . 0.0 111.989 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -67.54 -43.42 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.153 0.981 . . . . 0.0 111.748 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.21 -42.95 87.32 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.443 -0.786 . . . . 0.0 111.736 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.07 -40.0 83.84 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.918 -1.114 . . . . 0.0 112.447 170.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -33.91 77.04 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.45 1.1 . . . . 0.0 113.659 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.48 -9.49 59.62 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 18.72 55.46 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.046 -1.033 . . . . 0.0 114.621 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 mt -93.28 55.0 2.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.178 2.191 . . . . 0.0 110.002 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 -61.5 -38.89 88.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -167.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.28 -38.47 65.89 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.145 0.884 . . . . 0.0 110.917 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -66.02 -34.86 79.04 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 122.974 0.509 . . . . 0.0 111.967 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.39 -53.15 53.04 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.952 0.501 . . . . 0.0 111.986 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.2 t -63.26 -32.34 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.665 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -53.82 -51.47 63.43 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.175 0.898 . . . . 0.0 111.416 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 99.7 m -57.89 -40.2 79.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.083 0.953 . . . . 0.0 112.204 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -70.47 -41.25 73.0 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.717 0.689 . . . . 0.0 112.659 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.889 ' HD2' ' HZ3' ' A' ' 44' ' ' LYS . 35.3 m-20 -67.34 -25.52 66.04 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.896 0.771 . . . . 0.0 112.492 174.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -65.38 -32.0 73.4 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.342 -1.474 . . . . 0.0 111.767 169.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -68.03 -38.75 82.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.075 0.852 . . . . 0.0 110.919 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.9 mm -68.29 -37.23 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.697 0.799 . . . . 0.0 110.595 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.1 m -59.93 -32.49 70.83 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.951 1.3 . . . . 0.0 112.708 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.41 -16.85 20.99 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -138.36 51.56 3.91 Favored Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 123.958 0.903 . . . . 0.0 112.707 -166.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -61.62 -27.09 81.08 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.383 2.055 . . . . 0.0 116.803 -159.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -102.38 0.5 34.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -83.11 118.85 72.94 Favored Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.028 -1.045 . . . . 0.0 112.361 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -54.34 -25.42 39.1 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.079 2.519 . . . . 0.0 114.852 174.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -52.48 -44.61 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.058 0.943 . . . . 0.0 112.376 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -44.83 60.83 Favored Glycine 0 CA--C 1.528 0.876 0 O-C-N 121.56 -0.713 . . . . 0.0 112.359 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -60.78 -33.73 73.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.465 0.706 . . . . 0.0 111.859 173.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.0 t -68.43 -41.63 80.07 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.264 -0.897 . . . . 0.0 113.092 172.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -64.87 -35.37 80.92 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 118.676 0.671 . . . . 0.0 111.294 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.889 ' HZ3' ' HD2' ' A' ' 28' ' ' ASP . 78.4 tttt -73.37 -31.65 64.05 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.785 -1.197 . . . . 0.0 112.767 175.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.28 93.93 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.868 -1.145 . . . . 0.0 112.224 168.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 43.4 tpp -59.0 -40.5 85.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.051 0.941 . . . . 0.0 111.609 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.68 91.74 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.516 -0.74 . . . . 0.0 112.776 174.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.9 mt -66.14 -36.35 82.89 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.531 -0.731 . . . . 0.0 112.691 -176.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.6 pt -71.61 -28.8 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.737 1.153 . . . . 0.0 112.966 171.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.34 -20.85 36.49 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 tt -81.16 -32.82 33.49 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.286 1.434 . . . . 0.0 110.528 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.45 21.0 10.22 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.26 1.41 . . . . 0.0 114.842 175.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -96.11 57.86 1.79 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.875 1.338 . . . . 0.0 110.058 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -54.55 -37.86 65.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.854 1.262 . . . . 0.0 112.603 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.72 -23.28 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.245 1.018 . . . . 0.0 112.566 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -87.84 -31.72 19.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.826 0.85 . . . . 0.0 111.884 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -40.3 88.14 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.624 0.769 . . . . 0.0 112.162 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.1 pt -62.2 -38.96 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 118.828 0.74 . . . . 0.0 112.011 177.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.83 -44.69 92.45 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.688 0.795 . . . . 0.0 111.177 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.5 ttm -65.23 -31.35 72.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.784 0.72 . . . . 0.0 112.928 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.2 m -69.45 -42.82 74.41 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.994 -1.066 . . . . 0.0 111.817 174.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -62.11 -41.53 98.32 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.723 0.692 . . . . 0.0 111.947 172.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -34.95 77.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.453 1.101 . . . . 0.0 111.797 172.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.38 -30.33 56.91 Favored Glycine 0 CA--C 1.532 1.107 0 O-C-N 120.651 -1.28 . . . . 0.0 114.393 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.59 -30.02 68.38 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.58 1.69 . . . . 0.0 111.949 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -63.85 -16.7 61.96 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -92.57 34.71 1.05 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.164 1.385 . . . . 0.0 113.045 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.9 p -144.21 137.78 27.6 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 120.511 -1.368 . . . . 0.0 114.055 -166.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.7 t -163.73 -50.34 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 163.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -85.47 175.73 8.66 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.714 0.806 . . . . 0.0 112.895 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.01 -10.62 51.73 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -170.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -2.03 42.59 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.081 -1.012 . . . . 0.0 113.394 167.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -120.65 -9.46 9.36 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.285 1.434 . . . . 0.0 114.436 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -68.59 -31.21 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 O-C-N 119.845 -1.784 . . . . 0.0 113.535 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.02 -37.67 64.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.19 0.904 . . . . 0.0 111.649 165.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -57.08 -32.91 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.376 -0.828 . . . . 0.0 112.979 175.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.3 mtm180 -61.79 -44.74 96.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.191 0.996 . . . . 0.0 112.006 174.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.3 t -65.66 -38.78 90.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 118.747 0.703 . . . . 0.0 111.485 169.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -73.0 7.26 2.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.42 1.488 . . . . 0.0 114.367 176.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -114.83 -33.25 5.53 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.527 1.058 . . . . 0.0 112.629 153.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -68.13 -41.29 81.9 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 120.455 1.48 . . . . 0.0 114.116 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.59 78.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.434 -1.417 . . . . 0.0 111.191 173.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.754 HH22 ' HE2' ' B' ' -2' ' ' GLU . 24.2 mmt180 -60.93 -37.02 80.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.488 -0.758 . . . . 0.0 111.122 174.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 38.3 tp -70.21 -40.87 74.31 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.067 1.347 . . . . 0.0 112.441 174.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.99 -31.31 72.45 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.39 -0.819 . . . . 0.0 112.609 171.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -88.35 -22.84 23.6 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.25 95.86 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.596 1.544 . . . . 0.0 110.183 165.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -71.59 -31.91 67.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.477 1.111 . . . . 0.0 112.146 173.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.61 -47.18 63.47 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.26 1.409 . . . . 0.0 113.545 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.33 -26.29 60.06 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.261 1.424 . . . . 0.0 113.12 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.4 p -76.33 -33.49 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.022 0.828 . . . . 0.0 112.481 173.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -173.92 145.71 8.33 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-N 119.139 0.881 . . . . 0.0 114.635 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -101.57 146.34 27.81 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.785 1.634 . . . . 0.0 111.624 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.7 m -113.37 24.94 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.302 1.441 . . . . 0.0 113.815 -169.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -62.51 168.46 3.61 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.51 1.124 . . . . 0.0 113.439 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp 60.17 92.58 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 126.426 1.89 . . . . 0.0 109.627 -171.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -81.06 -38.78 0.23 Allowed 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.446 2.097 . . . . 0.0 113.925 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.2 t 51.22 40.86 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-O 122.315 1.055 . . . . 0.0 112.094 -166.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 86.6 t -144.39 115.18 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 127.425 2.29 . . . . 0.0 108.125 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 33.22 -103.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 127.026 2.13 . . . . 0.0 113.843 178.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 35.5 m -136.22 38.97 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 127.175 2.19 . . . . 0.0 111.761 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.67 -36.81 77.19 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -170.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -149.01 -62.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.467 1.107 . . . . 0.0 110.898 167.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 50.8 mt 66.28 130.67 0.03 OUTLIER Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 128.993 2.917 . . . . 0.0 115.33 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.44 131.78 23.98 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.712 2.942 . . . . 0.0 114.254 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 45.75 38.26 4.1 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.885 2.074 . . . . 0.0 115.19 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.16 -100.28 1.35 Allowed Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.405 1.479 . . . . 0.0 112.133 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.7 t80 64.63 12.34 7.46 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 117.891 2.552 . . . . 0.0 117.891 158.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -72.42 145.56 47.57 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.875 -1.765 . . . . 0.0 114.347 178.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 49.93 33.23 6.36 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.77 2.028 . . . . 0.0 113.745 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.253 1.258 0 C-N-CA 127.294 2.237 . . . . 0.0 114.411 -175.675 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.414 ' H1 ' ' CD ' ' A' ' 5' ' ' GLU . 1.8 mpt? . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -134.11 140.71 46.77 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.792 . . . . 0.0 111.433 175.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.754 ' HE2' HH22 ' A' ' 83' ' ' ARG . 2.6 mp0 -73.74 140.35 45.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.303 1.041 . . . . 0.0 111.653 -179.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 8.4 p -145.95 62.04 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.363 1.465 . . . . 0.0 108.729 174.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 C--O 1.25 1.118 0 C-N-CA 125.545 1.538 . . . . 0.0 113.701 -167.736 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.1 mtm . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -63.25 -12.51 29.41 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.33 1.604 . . . . 0.0 115.33 -173.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -52.67 -30.82 33.92 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.56 1.544 . . . . 0.0 113.242 171.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -92.66 -0.12 57.34 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 175.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -97.12 -37.95 9.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.212 1.805 . . . . 0.0 111.582 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -39.5 93.8 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.898 0.772 . . . . 0.0 111.499 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.85 -24.09 62.46 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -172.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -76.45 -36.62 57.82 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.185 -0.947 . . . . 0.0 112.942 171.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -66.24 -36.07 82.07 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.556 0.743 . . . . 0.0 112.261 170.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -63.65 -50.46 69.2 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.236 1.414 . . . . 0.0 111.088 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.84 -40.18 80.05 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.606 -0.684 . . . . 0.0 113.731 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.49 -37.72 83.27 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 118.765 1.282 . . . . 0.0 111.983 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 t -65.06 -46.03 82.89 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.228 0.611 . . . . 0.0 112.113 171.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.9 mt -57.68 -38.9 75.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.257 1.023 . . . . 0.0 111.996 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -56.59 -41.36 76.85 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.797 -0.564 . . . . 0.0 112.39 170.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -19.43 64.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.534 1.134 . . . . 0.0 113.901 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -91.84 -5.59 53.13 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.587 1.085 . . . . 0.0 113.693 168.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 11.35 72.1 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.15 -0.969 . . . . 0.0 114.526 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.5 mt -83.67 51.12 1.94 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.779 1.631 . . . . 0.0 110.616 175.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -55.76 -36.0 66.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.943 1.697 . . . . 0.0 112.85 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -86.94 -33.69 19.6 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.377 -0.827 . . . . 0.0 112.202 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -62.64 -41.02 98.8 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 118.511 0.596 . . . . 0.0 111.431 164.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.39 80.67 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.46 -35.15 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.729 -0.607 . . . . 0.0 111.205 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -62.63 -39.01 92.48 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.403 1.001 . . . . 0.0 112.029 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -64.77 -44.85 88.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.876 0.871 . . . . 0.0 111.781 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -63.06 -38.4 91.03 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.654 -0.654 . . . . 0.0 112.079 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.11 -26.45 68.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.641 1.176 . . . . 0.0 112.368 171.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -72.45 -27.68 62.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.302 1.41 . . . . 0.0 112.969 172.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.42 -44.0 92.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.728 1.149 . . . . 0.0 110.473 170.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.0 mt -66.32 -44.28 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.916 1.286 . . . . 0.0 110.103 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -61.01 -30.14 70.12 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.24 1.016 . . . . 0.0 112.384 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.77 -28.28 30.46 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 173.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -140.71 65.69 25.54 Favored Pre-proline 0 CA--C 1.562 1.409 0 C-N-CA 126.382 1.873 . . . . 0.0 111.552 -168.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -68.35 -19.19 43.96 Favored 'Trans proline' 0 C--N 1.353 0.806 0 N-CA-C 118.179 2.338 . . . . 0.0 118.179 -161.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -102.73 -8.66 20.67 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.381 -0.824 . . . . 0.0 112.736 177.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -77.3 140.76 65.55 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 121.21 -0.931 . . . . 0.0 112.352 -174.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.33 -9.01 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.541 2.161 . . . . 0.0 113.871 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 p -61.74 -46.16 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.948 -1.095 . . . . 0.0 112.233 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.13 -36.1 64.13 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 120.918 -1.114 . . . . 0.0 113.168 175.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -58.3 -39.68 79.96 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.707 1.254 . . . . 0.0 111.492 169.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.5 m -62.02 -29.98 70.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.716 0.806 . . . . 0.0 112.207 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -87.86 -29.45 20.9 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -63.16 -39.78 95.65 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 121.174 1.807 . . . . 0.0 111.205 165.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -34.1 75.86 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.904 -1.123 . . . . 0.0 112.925 169.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 tpt -63.75 -40.18 96.1 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.604 0.762 . . . . 0.0 111.724 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.94 86.96 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.708 0.685 . . . . 0.0 111.869 171.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -56.56 -41.7 77.32 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.42 1.009 . . . . 0.0 112.294 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.7 pt -76.1 -21.05 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.42 -15.7 22.81 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.031 1.287 . . . . 0.0 114.108 178.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.95 -28.4 15.82 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.455 1.902 . . . . 0.0 111.294 169.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 104.0 27.12 6.39 Favored Glycine 0 CA--C 1.531 1.078 0 N-CA-C 115.755 1.062 . . . . 0.0 115.755 173.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.02 54.49 1.12 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.385 1.088 . . . . 0.0 109.927 170.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -58.94 -32.79 69.91 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.726 1.21 . . . . 0.0 113.408 -169.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.8 m -75.12 -22.0 58.51 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.458 -0.776 . . . . 0.0 112.099 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.5 mm-40 -74.47 -36.57 63.31 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.58 -1.325 . . . . 0.0 110.931 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.66 -41.96 91.89 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.649 -0.657 . . . . 0.0 112.537 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.7 pt -61.63 -36.96 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.561 0.619 . . . . 0.0 111.998 176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -66.39 -50.33 63.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.297 1.039 . . . . 0.0 110.804 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.9 ttm -63.8 -32.3 73.77 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.1 -42.41 72.74 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 120.867 -1.145 . . . . 0.0 112.093 175.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -71.73 -33.53 68.8 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.112 0.869 . . . . 0.0 111.79 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -36.86 77.84 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.335 1.054 . . . . 0.0 112.418 164.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.26 -29.8 61.71 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 120.266 -1.521 . . . . 0.0 113.902 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.51 -21.8 62.86 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.558 1.679 . . . . 0.0 112.626 172.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -66.11 -9.18 28.81 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 170.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -109.23 27.75 9.21 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.762 2.025 . . . . 0.0 111.985 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 32.1 p -135.18 -0.78 2.69 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 -166.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 69.5 m -79.44 40.51 0.44 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.831 -1.168 . . . . 0.0 113.014 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 t -150.9 145.57 25.72 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.9 -13.53 11.35 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.981 1.312 . . . . 0.0 114.169 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -70.07 -28.04 65.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.769 1.228 . . . . 0.0 112.416 168.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -134.84 21.4 3.54 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.988 1.715 . . . . 0.0 112.697 -169.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.63 -35.22 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 120.642 -1.286 . . . . 0.0 112.168 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.0 68.19 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.21 -0.931 . . . . 0.0 111.784 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.0 mm -67.68 -31.81 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.154 -0.966 . . . . 0.0 111.018 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -57.2 -40.87 78.3 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.248 -0.908 . . . . 0.0 111.441 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.9 m -76.96 -35.45 57.22 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.351 1.46 . . . . 0.0 113.603 174.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -52.36 -63.46 1.13 Allowed 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.779 1.172 . . . . 0.0 110.74 168.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -70.52 -26.63 63.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.073 0.851 . . . . 0.0 112.737 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.81 -35.31 64.87 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.04 1.291 . . . . 0.0 114.012 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.6 65.48 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.965 1.257 . . . . 0.0 111.343 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.738 HH22 ' HE2' ' B' ' -2' ' ' GLU . 57.3 mmt-85 -56.1 -42.93 77.56 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 119.575 1.08 . . . . 0.0 111.406 170.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.7 tp -67.54 -40.68 85.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.801 1.24 . . . . 0.0 112.469 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.63 -37.08 85.97 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.95 0.5 . . . . 0.0 112.31 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.2 -20.78 31.76 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.64 -47.81 83.14 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.281 1.4 . . . . 0.0 110.669 169.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -76.02 -26.96 57.15 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 173.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -25.94 74.22 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 120.82 -1.175 . . . . 0.0 114.78 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -87.46 -33.7 18.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.92 1.288 . . . . 0.0 112.873 174.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.7 p -89.85 -30.49 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -173.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.53 52.18 4.08 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 118.117 2.007 . . . . 0.0 118.117 -152.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 m -67.83 143.97 55.54 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.535 1.168 . . . . 0.0 111.129 164.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 12.7 m -87.13 149.96 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -164.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -149.65 174.61 12.37 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.289 1.435 . . . . 0.0 113.159 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 9.4 mt 65.19 88.54 0.11 Allowed Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 127.795 2.438 . . . . 0.0 112.36 178.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.3 -15.02 16.2 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.942 2.428 . . . . 0.0 113.486 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . 0.329 15.9 m 55.08 0.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 118.859 2.911 . . . . 0.0 118.859 -177.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.01 5.46 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 126.458 1.903 . . . . 0.0 114.296 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -130.57 -175.06 3.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.244 1.418 . . . . 0.0 111.197 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 64.8 t -139.74 -29.97 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.805 1.242 . . . . 0.0 113.227 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -75.05 -27.99 60.22 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 115.921 1.822 . . . . 0.0 115.921 -166.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -104.38 -99.22 0.31 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.709 1.141 . . . . 0.0 109.551 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.1 mp 62.21 167.66 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.262 1.825 . . . . 0.0 112.004 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -77.37 168.17 23.33 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 CA-C-N 120.226 1.116 . . . . 0.0 112.032 166.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -51.95 123.6 10.77 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.525 1.53 . . . . 0.0 112.229 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.4 12.89 70.21 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 117.065 1.586 . . . . 0.0 117.065 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -80.05 -36.27 35.93 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.118 1.459 . . . . 0.0 113.454 -175.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.847 ' HD2' HH21 ' A' ' 110' ' ' ARG . 1.1 p-10 -61.7 154.37 25.6 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -173.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.847 HH21 ' HD2' ' A' ' 109' ' ' ASP . 41.4 mtm180 65.23 4.57 2.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.526 1.93 . . . . 0.0 115.647 -177.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 97.3 p . . . . . 0 C--O 1.251 1.177 0 C-N-CA 124.609 1.163 . . . . 0.0 113.65 170.947 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.4 mpt? . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 120.707 0.289 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -101.94 159.32 15.46 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.034 1.334 . . . . 0.0 112.044 168.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.738 ' HE2' HH22 ' A' ' 83' ' ' ARG . 25.9 mt-10 -95.33 112.62 24.3 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 109.62 173.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 5.9 p -97.89 -6.03 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 115.127 1.529 . . . . 0.0 115.127 -160.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 125.891 1.676 . . . . 0.0 114.147 179.042 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.5 mtt . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 121.25 0.548 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.9 m -93.98 -25.65 17.16 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.768 1.227 . . . . 0.0 112.394 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -61.96 -47.25 85.69 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.355 1.462 . . . . 0.0 112.029 -176.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -7.66 56.9 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -87.57 -47.85 8.38 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.938 1.295 . . . . 0.0 111.078 170.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -27.73 67.9 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.773 -1.204 . . . . 0.0 112.608 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -28.15 63.7 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.101 1.319 . . . . 0.0 114.042 175.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -76.02 -30.27 58.43 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.687 -1.258 . . . . 0.0 111.369 171.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -71.29 -30.54 66.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 169.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.24 -48.6 81.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.188 0.995 . . . . 0.0 109.743 163.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.2 -38.91 57.39 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.896 0.76 . . . . 0.0 113.738 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.413 ' ND2' ' H ' ' B' ' 0' ' ' ASP . 60.2 t30 -60.51 -47.86 84.32 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.432 1.116 . . . . 0.0 112.317 176.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.8 m -66.3 -36.22 82.4 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.355 0.662 . . . . 0.0 112.599 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -61.14 -44.69 96.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.258 -0.901 . . . . 0.0 111.055 175.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -58.89 -39.73 82.31 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.349 0.977 . . . . 0.0 112.656 169.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -27.93 65.88 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -84.75 -19.74 32.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.454 1.501 . . . . 0.0 113.07 170.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 9.69 38.22 Favored Glycine 0 N--CA 1.477 1.398 0 C-N-CA 125.256 1.408 . . . . 0.0 114.353 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.0 mt -87.41 55.74 3.65 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 127.734 2.414 . . . . 0.0 110.031 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -57.77 -40.2 79.23 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.429 1.092 . . . . 0.0 112.566 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -67.98 -39.34 83.31 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.144 0.884 . . . . 0.0 110.836 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.34 -33.14 71.12 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.255 1.022 . . . . 0.0 113.36 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.26 77.14 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.133 0.879 . . . . 0.0 112.377 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.86 -34.84 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.446 1.099 . . . . 0.0 111.402 174.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 -58.17 -33.85 69.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.286 0.948 . . . . 0.0 112.654 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 70.3 m -69.09 -46.15 68.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.803 0.729 . . . . 0.0 111.524 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -31.59 72.46 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.628 1.104 . . . . 0.0 112.067 174.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.51 -29.51 70.77 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.198 -0.939 . . . . 0.0 112.454 174.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -70.97 -30.45 66.72 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.396 0.998 . . . . 0.0 112.302 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.88 -54.01 47.9 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.849 0.75 . . . . 0.0 110.008 171.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 58.1 mt -73.94 -28.77 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 111.846 -171.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -71.06 -27.21 63.47 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 120.913 -1.117 . . . . 0.0 112.287 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.94 -25.75 27.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 168.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -143.77 78.09 14.49 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.729 1.611 . . . . 0.0 112.213 -166.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -67.1 -22.13 47.89 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.742 2.295 . . . . 0.0 115.575 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -133.98 -11.75 2.59 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -163.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -65.91 128.78 94.06 Favored Pre-proline 0 CA--C 1.547 0.857 0 O-C-N 120.604 -1.31 . . . . 0.0 108.644 164.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.62 -22.45 72.66 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.739 2.292 . . . . 0.0 114.063 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.18 -31.64 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.782 1.633 . . . . 0.0 114.23 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.65 -35.03 62.62 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.153 -0.967 . . . . 0.0 112.214 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -79.01 -37.3 39.5 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.193 0.997 . . . . 0.0 112.279 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.0 p -64.47 -30.41 71.44 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.5 -0.75 . . . . 0.0 112.835 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -79.43 -40.21 30.52 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 172.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -57.52 -40.49 78.88 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.151 0.887 . . . . 0.0 111.818 171.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.32 80.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 172.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -45.85 78.91 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.437 0.695 . . . . 0.0 111.935 172.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.78 -42.74 84.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.368 0.667 . . . . 0.0 111.512 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.99 -43.59 98.63 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.316 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.2 pt -72.47 -27.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 120.771 1.623 . . . . 0.0 113.585 175.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.5 -17.53 56.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.916 0.887 . . . . 0.0 113.164 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.26 -17.43 26.0 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.806 2.042 . . . . 0.0 112.02 166.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.89 29.97 21.91 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.023 1.297 . . . . 0.0 115.044 178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.65 52.57 0.83 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.977 2.511 . . . . 0.0 109.628 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -58.92 -36.93 75.55 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 120.942 -1.099 . . . . 0.0 112.434 -170.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 m -62.05 -22.67 65.94 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.106 0.962 . . . . 0.0 113.405 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -81.29 -36.34 29.94 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.962 -1.086 . . . . 0.0 111.714 171.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.15 -38.5 78.83 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.8 pt -66.94 -30.84 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.706 0.802 . . . . 0.0 113.012 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -66.0 -49.72 66.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.292 0.637 . . . . 0.0 110.791 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 25.5 ttm -65.99 -31.01 71.67 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.8 m -71.74 -34.98 69.99 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.048 -1.033 . . . . 0.0 112.533 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -70.5 -33.34 71.1 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.086 -1.009 . . . . 0.0 112.346 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.75 -27.35 66.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.494 0.718 . . . . 0.0 112.189 168.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.01 -23.65 48.16 Favored Glycine 0 CA--C 1.538 1.525 0 O-C-N 120.302 -1.499 . . . . 0.0 114.778 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.84 -27.72 44.39 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.603 1.701 . . . . 0.0 112.511 166.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -64.33 -2.66 2.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 115.81 174.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -117.93 28.13 8.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.953 1.701 . . . . 0.0 112.121 -174.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.8 p -123.46 -9.77 7.98 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -161.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.5 p -76.28 32.7 0.12 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -147.42 144.78 28.9 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 127.856 2.462 . . . . 0.0 110.606 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.66 -21.53 64.49 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -61.72 -22.86 65.72 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.49 1.116 . . . . 0.0 113.128 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -129.37 22.03 5.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.678 1.591 . . . . 0.0 113.045 -171.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.28 -27.3 38.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 O-C-N 120.568 -1.332 . . . . 0.0 112.704 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.13 -29.4 34.79 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.842 -1.161 . . . . 0.0 112.014 172.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.0 mm -65.68 -32.63 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.932 1.293 . . . . 0.0 110.945 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -63.15 -37.97 89.31 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.179 -0.95 . . . . 0.0 112.975 177.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.7 m -67.66 -46.01 73.62 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.667 0.787 . . . . 0.0 112.286 166.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.69 -56.12 13.4 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.597 1.159 . . . . 0.0 111.704 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.4 -31.12 68.21 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.598 1.09 . . . . 0.0 113.462 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -71.1 -40.84 71.27 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.748 1.158 . . . . 0.0 112.433 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.28 67.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.38 0.991 . . . . 0.0 111.931 173.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.349 1.431 . . . . 0.0 112.217 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.5 tp -64.94 -37.86 89.06 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.776 0.83 . . . . 0.0 112.229 176.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.47 -46.89 58.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 15.8 tp -73.02 -19.52 61.18 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.619 -1.3 . . . . 0.0 112.596 -177.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.36 87.35 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 120.27 1.395 . . . . 0.0 112.489 168.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . 0.328 0.9 OUTLIER -78.79 -9.75 59.55 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 169.725 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -82.74 -43.76 7.58 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.23 1.395 . . . . 0.0 114.106 166.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.36 -28.99 65.55 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.075 1.75 . . . . 0.0 113.253 -177.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.12 -26.75 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 172.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 170.93 147.74 5.73 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 124.592 1.091 . . . . 0.0 112.062 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.3 m -71.0 -11.76 61.15 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.1 t -127.32 130.75 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 125.936 1.694 . . . . 0.0 108.434 162.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 7.64 1.43 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.6 mt -70.39 121.36 83.12 Favored Pre-proline 0 CA--C 1.548 0.896 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 155.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -75.46 -11.72 20.65 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.257 3.305 . . . . 0.0 114.778 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 t 58.26 48.0 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-O 122.895 1.331 . . . . 0.0 111.106 -172.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 18.7 m -130.26 166.84 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.876 1.67 . . . . 0.0 110.352 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -63.67 -55.49 23.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 30.9 m -145.89 -24.55 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.96 -34.73 78.64 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -157.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -140.46 38.3 1.87 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.102 1.319 . . . . 0.0 113.589 -172.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.6 mt -64.4 163.32 26.67 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.556 1.542 . . . . 0.0 113.391 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -66.27 157.86 57.87 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.764 2.309 . . . . 0.0 111.929 158.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -62.28 135.23 57.37 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.861 1.264 . . . . 0.0 113.321 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 73.74 1.75 59.32 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 125.855 1.693 . . . . 0.0 115.988 175.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -69.41 -49.05 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.027 1.331 . . . . 0.0 112.204 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -157.3 169.87 23.77 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-O 122.184 0.992 . . . . 0.0 113.297 167.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 8.5 ptp85 -123.45 149.55 44.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.414 2.286 . . . . 0.0 110.982 176.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.483 1.185 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -169.648 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 76.8 mtp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -72.27 158.23 36.24 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.511 1.05 . . . . 0.0 113.404 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -150.52 152.96 34.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.173 -0.955 . . . . 0.0 113.422 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 23.5 t -22.45 123.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 129.452 3.101 . . . . 0.0 113.69 164.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . 0.413 ' H ' ' ND2' ' A' ' 12' ' ' ASN . 38.7 t70 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.455 1.902 . . . . 0.0 111.273 170.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.0 p -58.54 -37.3 75.37 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.409 1.484 . . . . 0.0 114.677 -166.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -65.76 -34.98 79.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.111 0.965 . . . . 0.0 111.928 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -15.74 57.2 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 175.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' HE2' ' HZ1' ' A' ' 8' ' ' LYS . 69.1 mm-40 -77.01 -48.33 18.23 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.894 -1.128 . . . . 0.0 111.355 166.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -35.6 81.02 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.547 -1.346 . . . . 0.0 112.527 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.41 -21.92 62.79 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HZ1' ' HE2' ' A' ' 5' ' ' GLU . 9.8 ptpp? -84.55 -38.04 20.48 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.782 1.174 . . . . 0.0 112.253 171.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.86 -32.34 73.82 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 111.736 176.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -56.49 -42.55 78.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.576 1.15 . . . . 0.0 112.107 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.69 -43.09 96.53 Favored Glycine 0 CA--C 1.533 1.216 0 O-C-N 121.587 -0.696 . . . . 0.0 113.252 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -64.5 -37.77 88.68 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.604 -0.939 . . . . 0.0 112.049 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.3 t -66.76 -45.56 78.18 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.654 -0.654 . . . . 0.0 111.877 173.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.33 -36.67 73.75 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 112.575 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.8 -40.73 80.6 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 170.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -38.76 91.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.938 0.895 . . . . 0.0 112.78 175.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 4.24 10.84 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 173.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.16 4.38 90.24 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 121.069 -1.019 . . . . 0.0 114.274 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.7 mt -88.95 55.44 3.35 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.863 1.665 . . . . 0.0 110.674 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -57.05 -39.68 75.33 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.958 0.903 . . . . 0.0 111.837 -175.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.94 -38.21 69.86 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.53 -0.731 . . . . 0.0 111.553 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.53 -40.3 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.252 1.021 . . . . 0.0 111.763 171.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.49 84.11 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.351 -0.843 . . . . 0.0 112.034 175.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -59.37 -35.9 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.743 1.217 . . . . 0.0 111.063 172.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -63.22 -45.55 91.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.438 1.095 . . . . 0.0 111.577 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.15 -43.94 93.65 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.54 1.136 . . . . 0.0 112.011 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -65.86 -35.21 80.03 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 0.0 112.396 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -67.94 -25.69 65.59 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.536 -0.728 . . . . 0.0 112.613 173.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.9 mm-40 -66.26 -34.7 78.6 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.283 1.401 . . . . 0.0 111.813 171.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.12 -48.11 83.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 118.689 0.677 . . . . 0.0 110.609 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.8 mt -72.03 -41.41 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.503 1.121 . . . . 0.0 110.212 -177.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.6 m -57.62 -37.93 74.1 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.768 0.827 . . . . 0.0 111.626 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.42 -29.25 47.03 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -136.08 62.16 44.15 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.625 1.57 . . . . 0.0 112.374 -168.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -64.42 -23.85 64.66 Favored 'Trans proline' 0 C--N 1.352 0.725 0 N-CA-C 117.516 2.083 . . . . 0.0 117.516 -161.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -104.01 4.85 34.93 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.267 1.027 . . . . 0.0 113.097 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -84.74 116.25 64.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 120.941 -1.1 . . . . 0.0 110.842 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.462 ' HA ' ' CD2' ' A' ' 41' ' ' TYR . 71.6 Cg_endo -64.19 -13.06 35.7 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.498 2.132 . . . . 0.0 114.223 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -52.24 -42.49 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 124.353 1.061 . . . . 0.0 112.228 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.01 -39.83 62.97 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.683 -0.509 . . . . 0.0 112.272 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 38' ' ' PRO . 2.7 m-30 -59.62 -38.99 82.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 117.576 0.688 . . . . 0.0 110.46 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.4 p -63.89 -35.93 82.27 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -79.43 -29.85 42.05 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.55 -0.718 . . . . 0.0 112.528 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -69.76 -33.17 72.05 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.417 1.008 . . . . 0.0 112.084 168.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.49 91.29 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.714 -1.241 . . . . 0.0 112.36 167.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.6 ttt -60.98 -37.81 83.74 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.641 -0.662 . . . . 0.0 111.865 170.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.58 -46.59 88.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.885 0.766 . . . . 0.0 111.761 173.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.1 mt -63.18 -37.4 87.07 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.554 -0.716 . . . . 0.0 112.678 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 26.6 pt -76.36 -7.64 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 172.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.37 -18.24 14.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.62 1.568 . . . . 0.0 113.207 176.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 tt -86.25 -34.64 20.35 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.563 1.945 . . . . 0.0 110.484 166.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.28 20.11 9.43 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.809 1.195 . . . . 0.0 114.961 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -96.35 53.61 1.33 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.015 1.726 . . . . 0.0 109.828 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -57.05 -34.58 68.39 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.778 1.231 . . . . 0.0 113.273 -169.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -66.63 -23.79 66.21 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.654 1.182 . . . . 0.0 112.299 176.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -85.63 -34.93 21.25 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.408 -0.807 . . . . 0.0 111.102 168.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.37 97.21 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.378 -0.826 . . . . 0.0 112.479 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.3 pt -59.78 -40.4 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.654 0.661 . . . . 0.0 111.799 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -64.73 -44.93 88.58 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.99 1.316 . . . . 0.0 111.238 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.2 ttm -68.24 -32.67 73.02 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.452 -0.78 . . . . 0.0 112.776 177.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.7 m -69.55 -42.62 74.34 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 120.802 -1.186 . . . . 0.0 111.853 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -60.72 -41.36 95.13 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.441 0.696 . . . . 0.0 111.357 172.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.95 -29.32 69.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 171.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.28 -28.25 45.29 Favored Glycine 0 N--CA 1.474 1.178 0 CA-C-N 120.768 1.622 . . . . 0.0 114.524 174.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.09 -20.76 65.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 119.887 1.844 . . . . 0.0 112.81 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -57.44 -11.98 2.29 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.51 1.524 . . . . 0.0 114.687 165.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -116.09 32.22 6.24 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 126.998 2.119 . . . . 0.0 112.242 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.6 p -136.99 8.48 2.99 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -167.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.2 m -78.62 2.89 17.85 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.4 t -144.27 156.08 44.12 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.891 -1.131 . . . . 0.0 113.177 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.12 -28.0 16.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.171 2.188 . . . . 0.0 116.734 -166.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -75.45 -0.0 18.57 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -132.27 16.91 4.52 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.974 1.71 . . . . 0.0 113.545 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.58 -27.73 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 119.534 -1.979 . . . . 0.0 113.338 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.85 74.2 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.655 -0.653 . . . . 0.0 111.193 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.29 -34.42 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.08 0.952 . . . . 0.0 111.033 174.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -52.51 -59.61 4.23 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.084 0.856 . . . . 0.0 109.901 171.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.7 m -61.64 -39.59 91.86 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.902 1.281 . . . . 0.0 113.115 176.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.898 ' HZ2' ' HE2' ' B' ' -2' ' ' GLU . 23.8 ttpt -79.44 4.4 15.64 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -110.65 -29.29 8.08 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 117.177 -1.392 . . . . 0.0 113.287 152.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -53.86 -57.72 9.91 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 121.315 1.871 . . . . 0.0 111.203 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -31.92 73.01 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.786 -0.571 . . . . 0.0 111.457 -172.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -62.98 -43.57 98.42 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.823 0.849 . . . . 0.0 111.152 174.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -66.92 -42.62 85.07 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.649 1.179 . . . . 0.0 111.194 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.3 -33.98 74.46 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.735 1.214 . . . . 0.0 113.095 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 18.8 mt -93.56 -12.29 29.87 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -46.21 78.41 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.932 1.696 . . . . 0.0 110.298 164.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -74.09 -16.24 61.03 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -76.06 -47.73 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.034 1.778 . . . . 0.0 113.579 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.19 -31.58 66.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.869 1.667 . . . . 0.0 112.816 -176.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.77 -15.72 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -139.96 -131.63 2.8 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 125.742 1.639 . . . . 0.0 112.848 -169.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 19.1 m -107.09 136.26 47.25 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.344 1.058 . . . . 0.0 112.096 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.5 m -100.31 172.38 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 126.006 1.722 . . . . 0.0 112.53 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -73.77 -158.25 0.06 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.368 1.067 . . . . 0.0 112.031 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.1 mt 60.27 67.82 1.55 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.926 1.69 . . . . 0.0 109.573 -170.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.67 -15.7 24.17 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.075 2.517 . . . . 0.0 113.317 -175.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 t 61.15 22.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 114.15 1.166 . . . . 0.0 114.15 -176.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.1 m -140.08 158.86 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.227 2.211 . . . . 0.0 108.972 170.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.03 147.73 46.26 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . 0.268 1.9 p 51.22 1.37 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 130.255 3.422 . . . . 0.0 119.064 171.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -86.11 53.76 2.9 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 119.529 -1.982 . . . . 0.0 115.846 -166.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . 0.258 21.2 tt0 68.42 50.84 0.69 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.207 1.803 . . . . 0.0 110.265 -174.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -87.02 156.42 54.93 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 126.483 1.913 . . . . 0.0 112.189 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.55 157.6 35.99 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 122.615 2.21 . . . . 0.0 114.299 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.77 -28.51 61.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.119 1.368 . . . . 0.0 114.06 -177.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -107.75 9.92 37.82 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.205 1.383 . . . . 0.0 115.744 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -88.56 -36.15 16.51 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.93 1.865 . . . . 0.0 114.85 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -128.92 -1.85 5.26 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -125.74 167.22 15.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.062 1.745 . . . . 0.0 111.177 170.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 78.3 p . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 126.774 2.03 . . . . 0.0 114.438 -176.888 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.46 -26.63 13.79 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.025 1.284 . . . . 0.0 112.201 167.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.898 ' HE2' ' HZ2' ' A' ' 79' ' ' LYS . 1.3 mt-10 63.91 171.07 0.17 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.588 2.355 . . . . 0.0 115.338 174.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 9.3 p -160.92 163.08 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 127.007 2.123 . . . . 0.0 108.993 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.253 1.26 0 C-N-CA 127.594 2.357 . . . . 0.0 116.01 -175.395 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -65.44 -20.25 66.29 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.049 -1.032 . . . . 0.0 113.541 -172.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -63.42 -42.47 98.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.42 1.488 . . . . 0.0 111.372 171.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -15.13 61.88 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.638 -1.289 . . . . 0.0 113.788 176.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.86 -46.67 14.91 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.927 0.891 . . . . 0.0 110.666 165.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -37.3 83.34 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.418 -1.426 . . . . 0.0 112.676 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -73.65 -24.26 59.98 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.918 0.887 . . . . 0.0 113.13 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -83.89 -31.81 25.5 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.15 0.886 . . . . 0.0 113.191 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.46 -45.38 69.19 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.928 0.785 . . . . 0.0 111.183 169.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -50.97 -48.15 61.21 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.841 1.256 . . . . 0.0 110.537 168.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.54 50.32 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 117.805 -1.553 . . . . 0.0 114.792 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -90.23 -41.91 11.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 121.061 2.431 . . . . 0.0 111.575 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.4 t -57.43 -36.83 71.88 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.549 -0.719 . . . . 0.0 112.338 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.2 mt -62.54 -39.64 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.96 -1.088 . . . . 0.0 112.207 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.99 -40.3 96.06 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.876 1.216 . . . . 0.0 112.585 169.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.71 -42.5 83.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.348 0.522 . . . . 0.0 112.223 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -74.7 -36.37 62.72 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.267 1.427 . . . . 0.0 113.278 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.36 10.4 8.0 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.382 1.467 . . . . 0.0 115.577 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -89.89 58.63 4.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.312 2.245 . . . . 0.0 109.64 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -60.07 -37.02 78.66 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.709 1.204 . . . . 0.0 113.595 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.5 mmt-85 -73.65 -42.37 61.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.73 0.695 . . . . 0.0 110.624 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -65.15 -30.04 70.93 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.3 14.09 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.49 0.716 . . . . 0.0 111.308 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.81 -35.31 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.989 1.315 . . . . 0.0 111.907 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -54.62 -45.79 73.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.724 0.809 . . . . 0.0 112.397 170.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.4 m -63.99 -38.92 92.85 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.167 0.894 . . . . 0.0 112.21 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -67.42 -35.83 80.05 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -65.11 -29.05 69.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 118.689 0.677 . . . . 0.0 111.908 174.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -72.3 -26.36 61.94 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.509 1.049 . . . . 0.0 112.764 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.0 mt -62.69 -49.31 75.6 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.204 0.601 . . . . 0.0 110.593 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.3 mt -80.93 -27.6 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.694 1.198 . . . . 0.0 111.195 -173.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.4 m -62.25 -27.89 69.32 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.383 -1.448 . . . . 0.0 112.194 168.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.78 -27.29 16.56 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 171.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -135.83 76.11 54.03 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.067 1.747 . . . . 0.0 110.426 -171.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -61.73 -25.0 78.27 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.938 3.092 . . . . 0.0 118.203 -166.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -116.46 -22.26 8.83 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.673 1.189 . . . . 0.0 112.502 -175.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.02 122.75 65.22 Favored Pre-proline 0 CA--C 1.545 0.777 0 O-C-N 121.657 -0.652 . . . . 0.0 112.57 -168.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.74 -20.4 51.13 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.112 2.541 . . . . 0.0 113.963 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.32 -32.65 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 119.114 0.87 . . . . 0.0 113.291 170.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.14 -40.89 15.05 Favored Glycine 0 C--N 1.34 0.778 0 O-C-N 121.409 -0.807 . . . . 0.0 111.846 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -70.93 -32.67 69.65 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -174.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.82 ' HG ' ' HE2' ' B' ' -2' ' ' GLU . 25.0 p -68.41 -41.12 80.88 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.722 1.601 . . . . 0.0 111.753 172.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -70.69 -36.44 73.3 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.832 0.853 . . . . 0.0 111.817 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -74.27 -29.5 61.69 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.565 -1.334 . . . . 0.0 112.115 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.04 -33.08 73.9 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.699 -1.251 . . . . 0.0 112.316 165.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -65.72 -40.58 92.37 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.333 -0.855 . . . . 0.0 111.189 171.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.96 86.79 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.586 -0.696 . . . . 0.0 112.516 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.63 -40.47 87.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.488 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 31.4 pt -76.38 -25.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 120.632 1.56 . . . . 0.0 113.452 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.17 -15.88 59.34 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 119.496 1.044 . . . . 0.0 113.268 172.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -92.28 -34.05 14.39 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.791 1.636 . . . . 0.0 111.734 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.16 25.1 5.18 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.557 2.027 . . . . 0.0 115.982 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -99.0 56.6 1.05 Allowed 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 118.941 1.371 . . . . 0.0 111.938 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -57.44 -30.45 65.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.028 1.331 . . . . 0.0 113.663 -173.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.4 m -72.42 -30.73 64.88 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.178 0.899 . . . . 0.0 112.491 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -78.46 -30.72 47.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.144 0.884 . . . . 0.0 111.281 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.67 -40.84 92.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.98 0.912 . . . . 0.0 112.516 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.9 pt -70.67 -25.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.6 tm0? -72.41 -44.15 62.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.677 0.672 . . . . 0.0 111.165 166.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.4 ttm -58.61 -31.83 68.45 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.78 0.718 . . . . 0.0 112.19 174.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 94.0 m -60.9 -46.89 88.84 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.512 -0.743 . . . . 0.0 112.572 171.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -68.87 -35.98 77.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.254 1.021 . . . . 0.0 112.209 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -27.22 69.01 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.764 0.826 . . . . 0.0 112.454 168.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.4 -27.15 52.85 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.285 -1.51 . . . . 0.0 114.139 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.07 -12.49 55.79 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.096 1.448 . . . . 0.0 112.863 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -71.37 -5.55 33.47 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.22 1.408 . . . . 0.0 114.716 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.54 29.46 5.74 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.467 1.507 . . . . 0.0 113.659 -167.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 70.3 p -117.77 -5.14 11.11 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 -161.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.89 30.57 0.5 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -155.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.8 p -144.32 163.85 32.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.009 1.324 . . . . 0.0 111.828 -176.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.15 -28.12 69.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.099 0.96 . . . . 0.0 113.192 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.16 -19.69 64.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.006 0.922 . . . . 0.0 112.809 172.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -127.66 12.51 6.87 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -171.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 p -64.62 -32.92 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 120.837 -1.164 . . . . 0.0 113.225 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.3 -37.32 52.94 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.273 -0.892 . . . . 0.0 110.645 170.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.17 -37.78 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.905 0.882 . . . . 0.0 112.681 171.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ttp85 -59.16 -40.99 87.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.91 0.884 . . . . 0.0 111.281 176.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.1 m -70.62 -39.44 73.72 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.966 0.906 . . . . 0.0 112.84 167.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -61.96 -29.65 70.39 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.202 1.365 . . . . 0.0 112.715 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.7 -38.28 19.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.717 1.144 . . . . 0.0 113.498 169.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -66.89 -40.75 87.86 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 120.362 1.437 . . . . 0.0 113.706 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -36.81 73.67 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.498 0.59 . . . . 0.0 111.05 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -61.84 -36.14 80.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.881 0.872 . . . . 0.0 111.674 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.9 tt -67.4 -51.21 54.56 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.372 1.469 . . . . 0.0 110.6 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.07 -36.14 74.56 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.506 1.122 . . . . 0.0 112.562 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.48 -7.06 59.4 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 173.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.31 39.19 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 120.876 1.671 . . . . 0.0 109.179 164.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -63.51 -29.0 70.34 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.713 . . . . 0.0 111.388 169.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.41 -43.87 60.59 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 125.784 1.659 . . . . 0.0 113.707 172.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -76.11 -23.07 54.9 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.1 p -87.95 -15.4 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.431 0.692 . . . . 0.0 112.839 167.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.89 -162.74 26.04 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.821 1.677 . . . . 0.0 114.223 177.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 28.6 m -128.15 113.85 16.25 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.379 1.072 . . . . 0.0 112.837 -174.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.5 p -99.47 153.62 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 125.247 1.419 . . . . 0.0 110.715 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.72 110.5 21.55 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.352 1.461 . . . . 0.0 111.09 -178.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 48.4 mt -126.77 84.47 62.92 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.996 0.919 . . . . 0.0 109.317 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -80.69 0.5 9.98 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.743 2.962 . . . . 0.0 114.762 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 59.05 27.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 115.378 1.621 . . . . 0.0 115.378 171.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 23.3 m -145.01 155.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 126.378 1.871 . . . . 0.0 109.453 177.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.4 ' HB3' ' H ' ' A' ' 101' ' ' VAL . 33.9 mt-10 50.34 -154.87 0.12 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.41 1.484 . . . . 0.0 114.659 -177.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.4 ' H ' ' HB3' ' A' ' 100' ' ' GLU . 27.6 m -134.01 20.01 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 128.836 2.855 . . . . 0.0 111.621 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -112.34 -46.24 3.2 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.727 -1.233 . . . . 0.0 112.944 -157.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -120.25 16.67 12.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.405 1.882 . . . . 0.0 113.867 -173.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 76.4 mt -72.67 173.9 5.15 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 128.048 2.539 . . . . 0.0 111.793 160.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -63.59 -175.89 0.29 Allowed 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 122.73 2.286 . . . . 0.0 111.693 154.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.79 118.72 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.557 -1.34 . . . . 0.0 111.647 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.47 -111.06 3.85 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 125.155 1.359 . . . . 0.0 112.765 -173.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 18.7 t80 58.08 -27.8 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.773 2.829 . . . . 0.0 118.466 -176.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -43.05 110.45 0.19 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 121.911 2.141 . . . . 0.0 112.894 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -76.65 13.52 0.98 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 126.554 1.942 . . . . 0.0 113.809 -169.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.93 2.092 . . . . 0.0 113.454 -171.583 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 19.8 ptm . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 120.445 0.165 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -150.19 162.54 40.26 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.607 1.163 . . . . 0.0 112.132 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.82 ' HE2' ' HG ' ' A' ' 42' ' ' SER . 27.3 mt-10 -106.1 -102.5 0.34 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.59 1.156 . . . . 0.0 109.513 172.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 14.6 m -136.67 166.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.794 1.638 . . . . 0.0 112.82 -169.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 127.304 2.242 . . . . 0.0 115.221 -173.18 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.3 p -67.15 -31.6 72.15 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -163.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -67.23 -46.08 74.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.853 0.751 . . . . 0.0 112.063 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.293 0.0 OUTLIER -71.22 -26.9 63.13 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.525 -1.36 . . . . 0.0 111.782 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -70.77 -13.73 62.16 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.04 -35.61 10.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.488 1.04 . . . . 0.0 112.878 166.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -70.77 -36.73 73.2 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.264 0.938 . . . . 0.0 113.116 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.66 -21.54 66.44 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.909 -1.12 . . . . 0.0 112.804 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.55 ' HE2' ' H ' ' B' ' -3' ' ' GLU . 35.5 mt-10 -90.52 -34.74 15.43 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.089 1.356 . . . . 0.0 112.481 172.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -56.08 -41.15 74.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.845 1.258 . . . . 0.0 111.811 174.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.14 -42.3 71.83 Favored Glycine 0 CA--C 1.54 1.608 0 O-C-N 121.442 -0.786 . . . . 0.0 113.546 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -68.57 -40.22 80.66 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.952 1.376 . . . . 0.0 111.289 175.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.6 m -58.74 -36.55 74.49 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.425 -0.797 . . . . 0.0 112.714 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.35 -34.04 76.48 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.88 -1.138 . . . . 0.0 111.809 173.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -70.49 -26.64 63.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.526 ' HZ2' ' HD2' ' B' ' 0' ' ' ASP . 0.1 OUTLIER -66.21 -51.12 60.71 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.368 1.44 . . . . 0.0 110.343 166.083 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -66.55 -33.64 76.12 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -175.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.32 -0.4 8.83 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.956 1.142 . . . . 0.0 115.956 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.2 mt -89.54 53.16 2.52 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.233 2.213 . . . . 0.0 111.342 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -56.08 -36.89 68.63 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.892 1.677 . . . . 0.0 112.971 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -83.27 -28.52 29.08 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.03 -1.044 . . . . 0.0 112.982 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -73.43 -29.0 62.28 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 118.722 0.692 . . . . 0.0 112.118 166.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.21 69.05 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 172.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.6 t -60.24 -37.19 72.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 O-C-N 121.15 -0.969 . . . . 0.0 111.065 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -62.57 -45.75 91.48 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.66 -0.686 . . . . 0.0 112.237 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.5 t -55.19 -47.92 74.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.366 1.067 . . . . 0.0 111.481 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -68.67 -29.95 68.53 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -68.72 -23.47 64.36 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.224 -0.923 . . . . 0.0 112.78 168.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -69.63 -34.84 74.62 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.755 1.161 . . . . 0.0 111.242 172.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.47 -48.55 77.21 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.901 0.773 . . . . 0.0 109.915 174.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.8 mt -63.14 -37.95 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.952 0.501 . . . . 0.0 110.789 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.6 m -58.46 -39.5 80.09 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.47 -0.769 . . . . 0.0 112.027 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.25 -31.0 43.4 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.43 74.49 20.05 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 124.572 1.149 . . . . 0.0 112.859 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -63.35 -28.56 71.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.641 2.894 . . . . 0.0 117.436 -168.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -105.62 4.84 30.67 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.027 1.331 . . . . 0.0 112.957 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.51 120.55 73.18 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.342 -0.849 . . . . 0.0 110.103 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -61.93 -14.59 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 122.318 2.012 . . . . 0.0 114.226 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.4 p -47.14 -50.56 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.155 0.982 . . . . 0.0 111.416 167.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.11 -43.45 93.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 123.924 0.773 . . . . 0.0 112.5 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -63.53 -40.83 98.05 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.356 0.662 . . . . 0.0 112.169 173.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.0 p -67.43 -35.29 78.95 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.34 -0.85 . . . . 0.0 112.761 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -72.25 -38.51 68.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.144 0.978 . . . . 0.0 112.352 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -71.18 -32.26 68.65 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.411 1.005 . . . . 0.0 112.479 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.38 -42.09 96.35 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.114 -0.991 . . . . 0.0 112.322 168.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.0 -42.59 94.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.845 0.858 . . . . 0.0 111.511 171.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.97 90.78 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.706 0.802 . . . . 0.0 112.414 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 48.9 mt -64.51 -34.92 79.35 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.61 -0.681 . . . . 0.0 112.812 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.8 pt -73.62 -35.78 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.73 1.15 . . . . 0.0 112.892 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -12.83 61.36 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.44 1.096 . . . . 0.0 113.159 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.8 tt -93.44 -41.19 9.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.566 1.947 . . . . 0.0 111.528 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 110.63 21.85 6.63 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 124.772 1.177 . . . . 0.0 115.064 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -100.87 51.48 0.86 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.564 1.546 . . . . 0.0 109.67 171.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -51.02 -41.7 59.98 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.6 1.96 . . . . 0.0 112.624 -176.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.1 m -63.72 -25.95 68.43 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 113.158 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -81.19 -35.9 30.8 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.179 -0.951 . . . . 0.0 111.233 171.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -39.41 91.77 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.803 0.841 . . . . 0.0 112.195 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.3 pt -64.32 -34.76 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.762 0.71 . . . . 0.0 112.474 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.5 tm0? -64.47 -47.91 77.22 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.811 0.732 . . . . 0.0 110.551 171.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.5 ttm -63.18 -31.34 72.46 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 178.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.8 m -66.83 -46.18 75.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.971 -1.08 . . . . 0.0 112.362 173.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -72.41 -32.7 66.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.622 0.769 . . . . 0.0 111.867 -178.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -39.0 92.87 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.953 1.301 . . . . 0.0 112.382 164.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.18 -28.19 73.02 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 120.196 -1.565 . . . . 0.0 113.969 177.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.71 -23.1 67.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.454 1.127 . . . . 0.0 112.857 168.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -74.2 -0.18 15.99 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 169.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.22 20.71 15.98 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.597 1.559 . . . . 0.0 113.103 175.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -139.11 126.72 21.84 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.355 -1.466 . . . . 0.0 114.036 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -148.67 -36.02 0.19 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.073 1.749 . . . . 0.0 112.429 167.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.9 p -76.65 167.37 21.96 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.317 1.447 . . . . 0.0 113.622 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.86 -21.03 66.03 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.9 -1.125 . . . . 0.0 113.148 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.37 -28.45 66.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.401 1.08 . . . . 0.0 112.756 170.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -120.87 15.72 11.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.228 1.411 . . . . 0.0 112.369 -169.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.79 -37.24 61.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.247 -0.908 . . . . 0.0 112.259 -178.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.51 -36.41 63.2 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.688 -0.633 . . . . 0.0 110.623 172.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.8 mm -53.08 -39.98 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.397 1.079 . . . . 0.0 112.447 168.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -34.3 76.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.246 1.019 . . . . 0.0 112.257 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.9 m -80.21 -33.33 38.21 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.112 0.965 . . . . 0.0 113.489 166.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -71.94 -3.07 20.51 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.341 1.456 . . . . 0.0 114.382 176.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -96.84 -47.64 5.77 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.182 0.901 . . . . 0.0 112.205 153.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.13 -32.09 69.93 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -171.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.43 -37.99 74.49 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.177 1.353 . . . . 0.0 111.019 173.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.358 4.5 ptp180 -80.41 -12.86 59.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.84 -44.14 67.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.452 1.101 . . . . 0.0 111.168 157.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -35.98 78.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.981 1.312 . . . . 0.0 112.815 171.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.93 -23.83 28.66 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.89 1.276 . . . . 0.0 113.826 176.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.7 75.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.349 1.431 . . . . 0.0 109.715 168.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -59.45 -26.31 65.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.733 1.213 . . . . 0.0 112.01 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.38 -58.7 7.55 Favored Glycine 0 N--CA 1.467 0.732 0 C-N-CA 127.351 2.405 . . . . 0.0 113.622 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.71 -31.73 68.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.1 0.96 . . . . 0.0 112.471 -174.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 2.2 p -83.8 -16.13 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -113.6 178.16 18.32 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 116.253 1.261 . . . . 0.0 116.253 -167.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -103.55 -30.6 10.4 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.826 2.05 . . . . 0.0 112.679 172.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.4 m -153.97 149.82 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 126.507 1.923 . . . . 0.0 112.576 174.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -90.49 143.6 26.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.433 1.093 . . . . 0.0 109.898 156.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.0 mt 57.78 79.22 0.33 Allowed Pre-proline 0 N--CA 1.478 0.97 0 C-N-CA 125.153 1.381 . . . . 0.0 110.526 -174.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -75.34 -6.02 17.33 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.294 1.996 . . . . 0.0 114.734 -174.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 18.6 t 51.84 80.58 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 126.497 1.919 . . . . 0.0 112.366 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 28.4 m -135.64 28.29 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.16 1.384 . . . . 0.0 112.937 -170.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . 0.292 7.8 mm-40 60.32 -92.84 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.851 1.66 . . . . 0.0 110.851 -158.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 94.2 t -140.36 123.27 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 125.189 1.396 . . . . 0.0 110.041 175.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -166.43 -61.47 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.021 1.328 . . . . 0.0 112.992 174.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -143.8 61.64 1.37 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.916 1.286 . . . . 0.0 112.004 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 mt -103.7 149.58 37.26 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.991 1.717 . . . . 0.0 110.861 175.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.24 125.95 14.29 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.511 2.141 . . . . 0.0 113.029 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 48.3 28.5 1.63 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.545 2.338 . . . . 0.0 114.961 -175.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.07 36.79 20.59 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.91 -1.119 . . . . 0.0 114.77 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -64.4 152.25 41.95 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.006 1.322 . . . . 0.0 113.136 172.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.923 ' HD2' HH11 ' A' ' 110' ' ' ARG . 0.6 OUTLIER 57.27 177.81 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 127.547 2.339 . . . . 0.0 116.381 -175.391 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.923 HH11 ' HD2' ' A' ' 109' ' ' ASP . 0.0 OUTLIER -139.31 172.22 13.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.991 2.117 . . . . 0.0 113.017 -171.628 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 88.7 p . . . . . 0 C--O 1.257 1.462 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -179.557 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.513 ' HB3' ' HE2' ' A' ' 9' ' ' GLU . 11.4 ttt . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 118.65 -0.691 . . . . 0.0 109.874 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . 0.55 ' H ' ' HE2' ' A' ' 9' ' ' GLU . 5.6 pt-20 -146.28 -4.68 0.6 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 175.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 58.6 48.88 11.16 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.305 1.442 . . . . 0.0 114.563 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 8.7 p -96.89 146.46 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.408 1.483 . . . . 0.0 112.301 178.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . 0.526 ' HD2' ' HZ2' ' A' ' 16' ' ' LYS . 37.5 t70 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.189 1.396 . . . . 0.0 114.628 -178.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.3 tpp . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.302 0.572 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.0 m -56.74 -33.09 66.2 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -170.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -72.32 -29.1 63.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 120.782 1.628 . . . . 0.0 112.844 177.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -24.42 60.98 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.805 -1.185 . . . . 0.0 113.118 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.445 ' HE2' ' HG2' ' B' ' -4' ' ' MET . 1.5 tp10 -83.98 -24.31 30.66 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.998 0.919 . . . . 0.0 111.841 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.2 tttt -70.05 -51.2 33.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.081 1.752 . . . . 0.0 111.674 162.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -25.19 66.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -166.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.72 -40.0 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 172.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.781 ' HE2' ' H ' ' B' ' -2' ' ' GLU . 63.2 mm-40 -71.19 -30.3 66.23 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.394 0.678 . . . . 0.0 111.655 175.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -68.1 -43.58 78.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.494 1.518 . . . . 0.0 111.05 170.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.36 -53.42 43.28 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.269 0.938 . . . . 0.0 112.679 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -56.37 -48.8 76.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.714 1.257 . . . . 0.0 111.659 174.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.7 t -55.92 -47.45 77.49 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.768 0.827 . . . . 0.0 113.153 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.4 mt -61.28 -28.56 69.27 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.278 -0.889 . . . . 0.0 112.815 -177.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -67.93 -37.49 81.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.282 0.946 . . . . 0.0 113.21 170.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -36.41 81.1 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 119.906 1.23 . . . . 0.0 112.648 172.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -74.5 -6.18 46.94 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 171.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.83 11.5 84.56 Favored Glycine 0 CA--C 1.537 1.462 0 O-C-N 120.37 -1.456 . . . . 0.0 114.992 -178.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 48.5 mt -87.32 54.33 3.11 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.844 2.058 . . . . 0.0 110.613 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -55.88 -36.19 67.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.359 1.063 . . . . 0.0 112.638 -170.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -80.56 -18.47 48.25 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.775 1.23 . . . . 0.0 113.01 -176.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.01 -36.41 17.04 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.063 0.545 . . . . 0.0 111.442 165.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.751 1.22 . . . . 0.0 112.733 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.51 -36.72 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.794 0.838 . . . . 0.0 110.389 172.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -64.85 -43.14 93.99 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.441 1.018 . . . . 0.0 112.872 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.67 -39.39 91.24 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.821 0.737 . . . . 0.0 112.263 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -75.31 -35.53 61.23 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 175.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -62.38 -36.02 81.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.336 0.971 . . . . 0.0 111.414 171.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -74.71 -15.9 60.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 113.271 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.65 -47.37 84.68 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.304 0.956 . . . . 0.0 110.682 160.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.1 mt -81.79 -25.94 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.337 1.055 . . . . 0.0 112.053 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 m -62.9 -33.15 74.71 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.572 -1.33 . . . . 0.0 111.183 169.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.83 -37.07 18.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.607 1.163 . . . . 0.0 113.404 174.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -129.86 74.14 80.87 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 125.86 1.664 . . . . 0.0 110.603 -169.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -63.13 -19.44 68.8 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.723 2.949 . . . . 0.0 117.537 -167.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -124.3 -10.73 7.5 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.443 1.097 . . . . 0.0 113.107 -171.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -70.13 122.87 87.56 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 124.014 0.926 . . . . 0.0 111.258 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -67.95 -9.23 24.99 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.999 1.8 . . . . 0.0 113.999 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -46.38 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.605 1.093 . . . . 0.0 110.989 163.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.52 -39.88 95.84 Favored Glycine 0 CA--C 1.527 0.802 0 O-C-N 121.266 -0.896 . . . . 0.0 112.03 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -65.36 -38.86 91.35 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 117.77 0.785 . . . . 0.0 112.128 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 m -62.44 -38.28 89.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.211 1.005 . . . . 0.0 112.041 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.49 HD21 ' HE2' ' B' ' -2' ' ' GLU . 25.7 m120 -75.14 -40.78 59.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.534 1.133 . . . . 0.0 112.224 175.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -65.12 -31.79 73.16 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 120.292 -1.505 . . . . 0.0 112.244 173.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.31 -36.53 83.98 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.259 -0.9 . . . . 0.0 112.561 169.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.4 tpp -63.58 -44.11 95.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.099 0.863 . . . . 0.0 111.276 171.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.09 -48.29 78.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.264 0.626 . . . . 0.0 112.08 175.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.59 -39.2 93.3 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.537 -0.727 . . . . 0.0 112.445 -177.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.52 -7.69 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 CA-C-N 120.07 1.305 . . . . 0.0 114.134 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.36 -20.1 14.72 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.053 1.341 . . . . 0.0 113.555 176.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.24 -9.7 49.73 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.411 2.284 . . . . 0.0 111.422 166.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.67 21.48 63.85 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.915 1.245 . . . . 0.0 114.866 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -92.59 51.2 1.7 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.561 1.944 . . . . 0.0 109.402 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -58.15 -37.17 74.14 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.081 -1.012 . . . . 0.0 112.445 -170.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.7 m -52.7 -31.81 39.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.899 1.28 . . . . 0.0 113.484 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -95.84 -27.09 15.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.353 1.461 . . . . 0.0 110.858 -177.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.21 -41.98 80.52 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.933 0.893 . . . . 0.0 112.078 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.5 pt -65.43 -35.01 74.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 118.999 0.818 . . . . 0.0 111.588 177.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -63.26 -45.54 91.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.013 0.925 . . . . 0.0 111.337 170.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 35.2 tpp -60.46 -43.76 96.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.955 0.798 . . . . 0.0 112.299 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.91 -46.61 84.04 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.128 -0.982 . . . . 0.0 112.246 177.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.75 -36.47 83.16 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.857 0.863 . . . . 0.0 112.181 174.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -38.48 84.73 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.176 0.99 . . . . 0.0 111.788 172.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.94 -34.17 65.44 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 120.269 -1.519 . . . . 0.0 113.598 178.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.78 -6.53 27.23 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 118.524 1.162 . . . . 0.0 113.401 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -76.48 -22.56 54.38 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 162.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -92.55 -7.31 47.57 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.862 1.265 . . . . 0.0 114.31 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.0 p -86.54 -1.13 57.37 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 -160.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 m -86.71 42.2 1.0 Allowed 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 120.206 1.366 . . . . 0.0 114.236 -169.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 p -138.62 159.65 41.57 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.198 1.399 . . . . 0.0 111.544 169.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.76 -6.97 17.99 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -87.18 -14.98 39.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.678 1.591 . . . . 0.0 112.259 171.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -126.36 14.51 7.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.455 1.502 . . . . 0.0 114.014 -173.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.19 -14.93 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 120.549 -1.344 . . . . 0.0 114.219 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.95 -39.19 15.95 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.914 -1.116 . . . . 0.0 111.267 164.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.6 mm -53.06 -36.48 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.132 0.973 . . . . 0.0 111.371 170.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.3 ttp180 -55.36 -39.5 70.14 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.831 1.252 . . . . 0.0 113.269 175.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.2 m -78.06 -37.9 45.65 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.036 1.335 . . . . 0.0 112.856 170.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.6 mttm -55.37 -51.72 65.88 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.943 1.247 . . . . 0.0 111.381 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.92 -31.19 64.47 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.092 1.315 . . . . 0.0 113.456 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -77.34 -30.72 54.09 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 120.971 1.714 . . . . 0.0 114.568 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -42.2 59.64 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.29 1.405 . . . . 0.0 110.655 166.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -62.16 -32.57 73.21 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.172 0.896 . . . . 0.0 111.688 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.5 tp -67.76 -44.28 77.87 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.756 1.222 . . . . 0.0 112.815 171.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -68.96 -32.46 72.06 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.282 -0.886 . . . . 0.0 113.352 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.6 tp -83.2 -22.12 33.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.46 -0.781 . . . . 0.0 112.678 174.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.92 92.39 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.522 1.51 . . . . 0.0 111.089 164.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -63.58 -30.04 71.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.033 0.933 . . . . 0.0 111.989 172.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.32 -49.57 44.68 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 125.697 1.617 . . . . 0.0 112.538 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.63 -37.55 70.86 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.738 1.215 . . . . 0.0 112.162 -177.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p -70.08 -34.3 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 121.42 -0.8 . . . . 0.0 111.655 174.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -89.41 8.68 79.31 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.215 1.864 . . . . 0.0 115.64 177.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.0 m -77.68 171.24 15.24 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.593 1.157 . . . . 0.0 111.547 173.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.25 18.1 m 53.37 16.55 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 128.191 2.596 . . . . 0.0 117.988 167.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 56.29 178.63 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.9 mt 64.0 77.59 0.3 Allowed Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 111.459 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -85.03 -5.37 9.62 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.574 2.85 . . . . 0.0 113.614 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 t 55.13 68.8 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.12 2.168 . . . . 0.0 113.062 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.48 35.0 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 127.318 2.247 . . . . 0.0 112.045 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 58.8 -59.65 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.372 3.069 . . . . 0.0 115.376 -166.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 27.7 m -143.02 -20.28 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -167.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -95.05 -18.6 20.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.472 2.027 . . . . 0.0 116.472 -154.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -144.17 115.52 8.03 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.231 1.812 . . . . 0.0 108.071 172.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.9 mt -159.25 155.28 23.51 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 124.912 1.285 . . . . 0.0 111.558 -173.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -67.05 157.77 60.11 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.024 1.816 . . . . 0.0 111.533 163.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.86 140.3 56.54 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -172.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.22 -1.93 73.25 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.057 1.313 . . . . 0.0 115.888 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -71.77 -51.19 23.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.362 1.581 . . . . 0.0 112.616 -176.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -156.13 -54.96 0.09 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.729 1.212 . . . . 0.0 111.997 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -156.62 -179.11 7.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 126.395 1.878 . . . . 0.0 111.753 -172.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.617 1.967 . . . . 0.0 112.411 -166.422 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.445 ' HG2' ' HE2' ' A' ' 5' ' ' GLU . 47.9 mtt . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . 0.493 ' H ' ' HE2' ' A' ' 9' ' ' GLU . 3.3 tp10 -126.64 -64.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.438 1.017 . . . . 0.0 111.83 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.781 ' H ' ' HE2' ' A' ' 9' ' ' GLU . 49.0 mt-10 46.93 88.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.162 2.185 . . . . 0.0 112.999 -172.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . 0.3 9.9 p -80.74 52.94 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.866 1.266 . . . . 0.0 113.963 -169.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . 0.265 35.4 m-20 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 129.688 3.195 . . . . 0.0 116.628 168.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.3 mmt . . . . . 0 N--CA 1.477 0.907 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 m -72.67 -29.29 63.29 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -155.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.76 -25.19 62.8 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.492 -1.38 . . . . 0.0 113.144 -176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -35.07 78.6 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.546 1.138 . . . . 0.0 112.332 170.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.473 ' HB2' ' HA ' ' B' ' -4' ' ' MET 0.257 0.2 OUTLIER -90.35 -14.43 33.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.92 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -27.97 32.94 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.667 1.187 . . . . 0.0 112.495 164.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -62.83 -50.68 70.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.958 1.303 . . . . 0.0 113.072 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -59.54 -30.48 68.63 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -49.59 49.5 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.727 -0.608 . . . . 0.0 110.912 171.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -58.72 -37.11 75.44 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.764 0.826 . . . . 0.0 111.56 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.89 -15.01 54.77 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.885 1.231 . . . . 0.0 115.176 174.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -94.84 -45.82 7.14 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.63 1.715 . . . . 0.0 110.754 168.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.3 m -53.41 -44.61 68.86 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.62 0.768 . . . . 0.0 112.755 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 mt -58.91 -38.11 78.18 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.246 1.018 . . . . 0.0 112.825 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -61.5 -38.16 86.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.283 -0.886 . . . . 0.0 112.05 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -71.17 -10.32 59.56 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -102.48 -0.79 31.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.018 1.327 . . . . 0.0 113.868 165.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.22 5.34 82.95 Favored Glycine 0 CA--C 1.536 1.365 0 O-C-N 121.116 -0.99 . . . . 0.0 115.001 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 98.3 mt -83.73 52.74 2.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.746 1.618 . . . . 0.0 110.952 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -56.87 -40.43 76.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.926 1.29 . . . . 0.0 111.924 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -72.96 -39.25 66.34 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.728 -0.653 . . . . 0.0 111.608 -178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -70.26 -32.65 70.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.445 1.02 . . . . 0.0 111.373 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.95 -44.3 89.87 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.015 -1.053 . . . . 0.0 112.183 173.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.97 -42.16 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.656 0.783 . . . . 0.0 110.924 171.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -58.53 -45.55 88.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.05 0.841 . . . . 0.0 112.516 174.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.2 m -62.72 -41.84 99.36 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.538 1.135 . . . . 0.0 112.5 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -67.48 -36.35 80.95 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.462 -0.774 . . . . 0.0 112.244 172.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.37 -28.52 69.75 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.722 0.692 . . . . 0.0 112.576 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -68.99 -28.81 66.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.89 -1.131 . . . . 0.0 112.229 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -63.5 -48.09 79.02 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.772 0.715 . . . . 0.0 110.373 169.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.6 mt -72.11 -24.72 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 C-N-CA 124.845 1.258 . . . . 0.0 111.241 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 94.5 m -68.32 -31.28 70.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.754 1.222 . . . . 0.0 111.455 172.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -85.41 -32.84 22.14 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.985 0.811 . . . . 0.0 112.803 169.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -132.21 77.71 70.29 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.18 1.392 . . . . 0.0 112.672 -169.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -65.98 -18.32 56.91 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 121.87 1.713 . . . . 0.0 115.088 175.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -113.3 -26.72 8.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.042 1.337 . . . . 0.0 112.896 -170.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -70.46 127.44 92.06 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.193 1.361 . . . . 0.0 111.486 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -67.9 -7.63 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.725 2.284 . . . . 0.0 115.277 -176.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 p -55.48 -39.61 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.808 1.243 . . . . 0.0 111.687 171.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.9 -45.56 32.85 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.365 -0.834 . . . . 0.0 112.115 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -64.75 -40.38 95.21 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.744 -0.857 . . . . 0.0 112.388 177.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 72.1 p -69.89 -18.52 63.41 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -83.9 -40.42 18.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 112.078 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.51 -37.69 73.4 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.64 -1.287 . . . . 0.0 112.018 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.98 -29.6 70.94 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 171.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.45 -42.68 87.28 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.042 0.837 . . . . 0.0 111.059 173.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.8 -46.42 87.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.966 0.506 . . . . 0.0 111.602 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 99.3 mt -59.27 -42.31 90.9 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.873 -0.517 . . . . 0.0 112.367 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.6 pt -73.73 -29.46 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.131 0.878 . . . . 0.0 113.339 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.56 -14.16 57.18 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.962 1.256 . . . . 0.0 114.095 175.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.5 tt -87.95 -23.16 23.95 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.39 1.876 . . . . 0.0 111.497 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.75 21.67 33.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.44 1.019 . . . . 0.0 114.463 -177.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -100.58 53.19 0.87 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.039 1.4 . . . . 0.0 110.734 173.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -52.36 -37.92 57.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.774 1.63 . . . . 0.0 112.378 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m -68.59 -15.44 63.53 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.042 1.737 . . . . 0.0 113.376 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -90.53 -33.66 15.84 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.37 -0.831 . . . . 0.0 111.588 165.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.6 -35.15 79.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 113.13 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 pt -62.74 -36.39 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.229 0.922 . . . . 0.0 112.985 177.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -67.06 -41.98 85.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.211 0.605 . . . . 0.0 111.605 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 ttm -76.38 -29.52 57.17 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.79 -39.34 73.2 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.019 -1.051 . . . . 0.0 111.207 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -59.79 -44.03 94.14 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.107 0.867 . . . . 0.0 111.536 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.43 -35.29 71.88 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 175.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.41 -27.18 52.73 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-N 120.265 1.393 . . . . 0.0 114.415 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -59.7 -32.74 70.8 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.266 2.033 . . . . 0.0 112.171 172.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -60.9 -17.61 51.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -85.51 -1.22 56.85 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.595 1.158 . . . . 0.0 112.942 175.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.7 p -106.0 22.06 16.27 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -162.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m -66.18 -32.79 74.44 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 p -104.8 166.65 10.24 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -174.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.87 -23.29 67.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.62 -22.83 64.2 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.828 -1.17 . . . . 0.0 112.656 174.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -124.17 17.46 9.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.21 1.804 . . . . 0.0 112.273 -169.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.09 -27.5 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.567 -1.333 . . . . 0.0 112.919 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.97 63.81 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.284 -0.885 . . . . 0.0 111.038 171.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.8 mm -58.83 -30.72 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.165 0.986 . . . . 0.0 111.261 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -64.94 -38.26 90.39 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.939 -1.1 . . . . 0.0 113.013 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.5 t -68.37 -43.29 77.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.302 1.441 . . . . 0.0 111.529 167.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.3 tppt? -54.21 -53.44 53.53 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.94 0.896 . . . . 0.0 111.814 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -74.23 -31.1 62.46 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 120.098 1.317 . . . . 0.0 114.011 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -75.28 -36.03 61.24 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.743 1.611 . . . . 0.0 113.433 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 -38.58 82.24 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.805 1.639 . . . . 0.0 110.828 172.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.695 HH12 ' HE2' ' B' ' -2' ' ' GLU . 43.3 mmt-85 -56.06 -37.44 69.28 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 119.494 1.043 . . . . 0.0 111.627 172.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.8 tp -72.78 -42.83 63.53 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.263 1.025 . . . . 0.0 112.904 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -67.38 -23.66 65.61 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 175.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -97.77 -20.16 17.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.035 1.334 . . . . 0.0 114.211 174.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.27 -49.42 77.92 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.61 1.55 . . . . 0.0 109.498 163.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -64.44 -26.97 68.68 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.427 1.091 . . . . 0.0 112.484 171.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -80.81 -33.94 28.91 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.45 1.024 . . . . 0.0 115.406 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -93.88 -26.01 17.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.014 1.326 . . . . 0.0 112.926 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.2 p -67.8 -35.43 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.259 0.936 . . . . 0.0 111.75 170.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 155.46 100.96 0.18 Allowed Glycine 0 C--N 1.341 0.834 0 C-N-CA 124.497 1.046 . . . . 0.0 111.434 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 36.2 m -63.55 139.72 58.8 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.79 1.236 . . . . 0.0 113.207 -172.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 35.1 m -125.21 3.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 125.824 1.649 . . . . 0.0 112.839 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -123.58 168.0 13.19 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.838 1.655 . . . . 0.0 112.739 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.0 mt 55.19 63.02 7.11 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 126.85 2.06 . . . . 0.0 111.206 -174.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -80.72 -17.23 9.91 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.8 2.334 . . . . 0.0 113.07 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.4 t 52.56 58.85 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.838 1.655 . . . . 0.0 113.191 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.2 m -141.37 -158.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 126.874 2.07 . . . . 0.0 110.512 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -73.55 163.97 27.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 122.489 1.138 . . . . 0.0 112.679 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.37 139.62 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -166.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -151.47 -54.62 0.14 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.594 1.958 . . . . 0.0 109.796 170.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -141.06 -62.31 0.48 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.89 1.676 . . . . 0.0 111.476 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.8 mp 60.41 170.26 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 C-N-CA 126.959 2.104 . . . . 0.0 114.961 168.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.3 157.52 35.17 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.851 2.367 . . . . 0.0 111.977 172.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.86 ' HE2' HH21 ' A' ' 110' ' ' ARG . 0.2 OUTLIER -60.71 131.12 49.69 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.558 0.694 . . . . 0.0 112.483 -170.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.71 61.68 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.957 1.265 . . . . 0.0 115.706 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -63.3 -51.19 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.216 2.008 . . . . 0.0 112.18 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -158.05 153.03 25.31 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.596 1.558 . . . . 0.0 110.28 169.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.86 HH21 ' HE2' ' A' ' 106' ' ' GLU . 28.6 mmt85 -126.24 139.88 52.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.21 1.004 . . . . 0.0 112.153 176.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.25 1.128 0 C-N-CA 127.879 2.471 . . . . 0.0 112.631 168.077 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.473 ' HA ' ' HB2' ' A' ' 5' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -108.49 161.42 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -160.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.695 ' HE2' HH12 ' A' ' 83' ' ' ARG . 95.6 mt-10 -98.58 143.45 28.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.676 0.791 . . . . 0.0 111.437 168.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 30.2 t -121.85 104.68 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.019 1.328 . . . . 0.0 108.662 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 117.162 -1.399 . . . . 0.0 114.741 -162.803 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.3 m -57.42 -34.31 68.8 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -170.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -75.03 -20.89 59.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.43 1.014 . . . . 0.0 112.875 175.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.59 -17.9 55.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.596 -1.315 . . . . 0.0 113.18 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.733 ' HE2' ' HA ' ' B' ' -4' ' ' MET . 4.4 mm-40 -74.16 -46.04 44.84 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.965 -1.084 . . . . 0.0 109.632 162.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -43.1 80.65 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.596 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.48 -24.38 61.17 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 120.223 1.374 . . . . 0.0 113.689 -178.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.264 10.9 ptpp? -77.85 -39.03 44.77 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 119.431 1.014 . . . . 0.0 112.71 169.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.14 -40.7 94.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.192 0.997 . . . . 0.0 112.277 170.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -60.85 -49.14 78.69 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.056 1.742 . . . . 0.0 111.34 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -39.36 97.14 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 119.409 1.004 . . . . 0.0 113.134 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -61.03 -42.3 98.22 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.626 1.713 . . . . 0.0 111.948 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.3 m -61.1 -44.4 97.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.218 1.007 . . . . 0.0 111.415 174.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.7 -38.92 92.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.747 1.219 . . . . 0.0 112.093 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -59.66 -35.68 74.9 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.599 1.091 . . . . 0.0 112.435 170.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -19.88 64.96 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 174.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -100.79 3.7 42.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.313 1.045 . . . . 0.0 113.239 170.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.92 13.47 83.36 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 121.122 -0.986 . . . . 0.0 114.768 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.6 mt -87.71 56.32 3.86 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.202 1.801 . . . . 0.0 110.344 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -57.33 -39.56 76.12 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.486 1.114 . . . . 0.0 113.246 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.02 -39.35 75.85 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.95 0.795 . . . . 0.0 110.751 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -64.63 -43.6 93.17 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.407 0.683 . . . . 0.0 111.045 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.31 76.81 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.876 0.871 . . . . 0.0 112.714 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.62 -38.48 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.013 0.925 . . . . 0.0 110.442 173.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -61.11 -42.99 99.55 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.089 0.859 . . . . 0.0 112.865 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.3 m -63.39 -35.13 79.37 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.764 0.826 . . . . 0.0 112.668 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -80.73 -34.15 34.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.28 1.032 . . . . 0.0 112.478 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -62.92 -34.61 77.8 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.211 0.914 . . . . 0.0 110.963 168.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -71.31 -17.65 62.44 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.5 mt -59.41 -46.48 88.58 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.678 1.126 . . . . 0.0 110.605 161.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.4 mt -77.24 -30.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.383 1.073 . . . . 0.0 111.206 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.1 m -62.64 -41.49 99.07 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.662 -1.274 . . . . 0.0 111.113 174.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.92 -30.26 61.2 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 174.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -137.78 62.02 32.45 Favored Pre-proline 0 CA--C 1.556 1.209 0 C-N-CA 124.542 1.137 . . . . 0.0 113.391 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -61.89 -27.97 80.68 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.549 2.166 . . . . 0.0 116.429 -165.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -103.03 -1.43 29.26 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.186 0.995 . . . . 0.0 113.082 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -84.33 123.9 74.43 Favored Pre-proline 0 CA--C 1.543 0.695 0 O-C-N 120.878 -1.139 . . . . 0.0 112.179 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -55.24 -23.81 38.87 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.478 . . . . 0.0 114.928 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.72 -38.95 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.471 1.032 . . . . 0.0 112.844 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.08 -46.31 59.14 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 119.305 0.957 . . . . 0.0 111.521 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -62.91 -40.46 97.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.47 1.108 . . . . 0.0 112.189 173.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.2 m -58.96 -34.5 71.85 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.241 1.016 . . . . 0.0 112.626 174.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.46 -44.19 17.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.794 0.838 . . . . 0.0 111.337 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -60.08 -34.7 73.81 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 121.087 1.767 . . . . 0.0 112.196 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.14 -34.18 77.06 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 168.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.1 tpt -66.11 -44.29 84.75 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.272 1.029 . . . . 0.0 111.727 172.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.62 -45.9 88.23 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.087 0.955 . . . . 0.0 112.065 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.55 -36.02 77.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 118.789 -0.624 . . . . 0.0 112.666 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.1 pt -84.08 -17.24 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 173.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -21.45 46.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.066 1.346 . . . . 0.0 112.049 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -88.2 -63.15 1.34 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.327 1.851 . . . . 0.0 109.542 172.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.66 15.77 0.73 Allowed Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.276 1.271 . . . . 0.0 116.276 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.06 59.71 1.98 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.304 1.552 . . . . 0.0 109.648 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.1 -30.33 68.02 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.602 1.161 . . . . 0.0 113.509 -173.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.7 m -70.11 -20.46 63.19 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.968 0.804 . . . . 0.0 112.176 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -79.09 -34.3 43.69 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.35 -1.469 . . . . 0.0 112.149 166.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.87 -45.5 64.3 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.8 pt -59.56 -40.49 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 CA-C-N 119.411 1.005 . . . . 0.0 111.857 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.0 tm0? -63.35 -49.08 75.31 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.461 1.104 . . . . 0.0 110.924 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.9 ttm -66.11 -28.14 68.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -64.69 -47.26 79.02 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.137 -0.977 . . . . 0.0 111.415 171.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -67.91 -36.09 79.59 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.932 0.493 . . . . 0.0 111.867 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -35.43 74.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.544 0.738 . . . . 0.0 112.565 166.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -73.13 -28.56 66.14 Favored Glycine 0 N--CA 1.471 1.006 0 CA-C-N 120.17 1.35 . . . . 0.0 114.433 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.06 -26.05 68.66 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.371 1.585 . . . . 0.0 112.688 175.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -59.23 -16.96 24.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.103 1.361 . . . . 0.0 114.447 172.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -95.92 13.7 25.97 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.189 1.795 . . . . 0.0 113.967 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.258 16.4 p -122.51 -126.06 0.26 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.51 1.124 . . . . 0.0 113.171 -164.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 74.5 m 56.32 27.33 11.74 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 126.983 2.113 . . . . 0.0 116.475 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.6 t -149.38 154.21 38.57 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.534 -1.354 . . . . 0.0 113.04 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.89 66.94 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 -167.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -77.54 -6.73 54.65 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -124.22 6.97 8.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.512 1.525 . . . . 0.0 113.356 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -64.61 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.357 -1.464 . . . . 0.0 113.553 -173.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.93 -42.23 66.9 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.304 -0.873 . . . . 0.0 111.308 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.24 -41.0 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.05 0.94 . . . . 0.0 111.804 170.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 69.0 ttt-85 -58.18 -47.54 83.11 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.141 0.576 . . . . 0.0 109.868 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.3 m -65.17 -32.3 73.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 117.424 -1.274 . . . . 0.0 113.895 175.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.579 ' HD3' ' HE2' ' B' ' -2' ' ' GLU . 47.7 mttm -55.19 -48.33 73.95 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.674 1.579 . . . . 0.0 110.997 168.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -75.5 -29.02 59.39 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -61.18 -50.48 72.96 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.556 1.525 . . . . 0.0 111.828 170.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -37.04 49.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.015 -0.517 . . . . 0.0 111.8 -174.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -59.48 -35.4 74.03 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.189 0.904 . . . . 0.0 111.588 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.03 -45.96 83.28 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.224 0.92 . . . . 0.0 112.102 172.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.53 -26.78 63.73 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.3 tt -89.61 -28.72 19.34 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.832 0.742 . . . . 0.0 112.622 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.22 -46.05 86.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.534 1.516 . . . . 0.0 111.727 173.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.57 -23.87 67.41 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.686 0.794 . . . . 0.0 112.814 171.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.85 -55.96 10.2 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.833 2.159 . . . . 0.0 114.29 170.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.62 -25.98 64.2 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.138 -1.213 . . . . 0.0 113.221 -176.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.1 p -80.99 -9.56 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 121.212 -0.93 . . . . 0.0 113.219 168.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.44 9.15 84.48 Favored Glycine 0 CA--C 1.535 1.286 0 O-C-N 120.719 -1.238 . . . . 0.0 115.32 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.8 m -75.81 -1.64 26.13 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.783 1.292 . . . . 0.0 114.008 -177.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.3 t -60.32 131.97 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-N 119.268 0.94 . . . . 0.0 110.686 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -121.05 144.6 48.46 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.954 1.702 . . . . 0.0 110.388 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 31.2 mt 58.64 76.53 0.45 Allowed Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.881 1.672 . . . . 0.0 111.639 176.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -80.92 4.42 6.98 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.563 2.175 . . . . 0.0 114.129 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.62 ' HA ' ' HD2' ' A' ' 109' ' ' ASP . 4.2 t 62.26 65.67 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.948 1.699 . . . . 0.0 112.477 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.0 t -142.72 89.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.489 1.116 . . . . 0.0 111.111 -175.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 48.13 -63.65 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 130.104 3.362 . . . . 0.0 118.971 165.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 p -166.39 -34.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 126.936 2.094 . . . . 0.0 112.755 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.76 -41.62 64.89 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.52 1.674 . . . . 0.0 115.52 -162.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -115.68 26.11 10.27 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.187 -0.946 . . . . 0.0 113.243 -164.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mt -105.3 160.37 26.26 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 125.791 1.636 . . . . 0.0 110.139 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -62.46 -24.62 75.57 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.727 2.285 . . . . 0.0 115.234 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -147.32 -46.21 0.17 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.17 0.988 . . . . 0.0 113.248 168.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 170.21 27.95 0.02 OUTLIER Glycine 0 CA--C 1.536 1.398 0 N-CA-C 116.579 1.391 . . . . 0.0 116.579 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -51.81 -36.96 49.83 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -167.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.62 ' HD2' ' HA ' ' A' ' 98' ' ' VAL . 1.2 m-20 -71.16 -29.44 65.21 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.769 -1.207 . . . . 0.0 113.719 177.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 42.35 76.34 0.08 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 128.471 2.708 . . . . 0.0 115.455 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 63.2 m . . . . . 0 C--O 1.251 1.15 0 C-N-CA 124.83 1.252 . . . . 0.0 113.546 171.602 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.733 ' HA ' ' HE2' ' A' ' 5' ' ' GLU . 14.5 mmt . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 119.803 -0.141 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -108.78 165.52 11.5 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.951 1.3 . . . . 0.0 111.47 175.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.579 ' HE2' ' HD3' ' A' ' 79' ' ' LYS . 14.1 tt0 -158.47 153.61 25.45 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 120.399 -1.438 . . . . 0.0 114.775 175.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.68 179.18 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 127.209 2.204 . . . . 0.0 112.821 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.796 1.638 . . . . 0.0 115.134 -174.457 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 tmm? . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 121.386 0.612 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.4 m -66.52 -39.7 88.77 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.23 1.412 . . . . 0.0 114.345 -161.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -63.45 -22.18 66.74 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -38.87 10.08 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.705 1.138 . . . . 0.0 112.802 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -66.02 -16.12 63.63 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -33.15 22.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.901 0.881 . . . . 0.0 113.37 166.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -70.38 -36.56 74.18 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.324 -0.86 . . . . 0.0 112.189 -172.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.474 ' HZ1' ' HE2' ' B' ' -2' ' ' GLU . 10.7 ptpt -57.7 -41.04 80.89 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.438 1.095 . . . . 0.0 112.651 173.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -69.67 -34.52 74.1 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.043 0.537 . . . . 0.0 111.971 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -65.24 -34.4 78.27 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.259 1.024 . . . . 0.0 111.537 169.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.42 -49.19 58.19 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.294 1.426 . . . . 0.0 113.952 170.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -55.29 -34.63 64.29 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 118.632 1.216 . . . . 0.0 110.951 171.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.9 t -70.63 -40.62 72.99 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.46 1.104 . . . . 0.0 113.487 172.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.3 mt -57.34 -41.09 79.33 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.22 1.373 . . . . 0.0 111.314 174.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -58.46 -39.98 81.41 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.132 0.878 . . . . 0.0 111.703 170.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -31.3 72.46 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.719 1.208 . . . . 0.0 114.079 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.71 -8.01 59.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.738 1.215 . . . . 0.0 113.761 171.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.489 ' HA2' ' CE1' ' A' ' 20' ' ' TYR . . . 91.16 6.2 66.91 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.995 -1.066 . . . . 0.0 114.437 -173.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 47.2 mt -82.86 44.51 0.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.49 1.516 . . . . 0.0 110.615 -177.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.489 ' CE1' ' HA2' ' A' ' 18' ' ' GLY . 5.0 m-85 -55.76 -34.86 65.6 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 113.032 -168.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -76.84 -35.52 57.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 120.503 1.502 . . . . 0.0 112.116 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.13 -24.48 62.28 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.206 0.603 . . . . 0.0 112.268 168.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.92 -35.47 37.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.958 0.903 . . . . 0.0 113.105 174.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.97 -40.36 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 O-C-N 121.015 -1.053 . . . . 0.0 110.402 168.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.01 -35.84 64.81 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.122 0.569 . . . . 0.0 112.026 169.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 t -67.81 -50.86 54.54 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.726 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -34.98 76.01 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.536 1.062 . . . . 0.0 111.58 178.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -62.21 -29.77 70.61 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.611 0.764 . . . . 0.0 112.679 174.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -65.93 -39.78 90.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.245 1.384 . . . . 0.0 111.714 171.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.5 mt -64.54 -37.63 88.22 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.855 -0.528 . . . . 0.0 110.511 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -80.33 -20.72 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 C-N-CA 125.458 1.503 . . . . 0.0 111.533 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.4 m -78.55 -44.44 24.21 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.156 -1.59 . . . . 0.0 111.588 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -91.57 -20.66 21.44 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -133.92 62.26 56.63 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 124.833 1.253 . . . . 0.0 112.169 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -57.45 -27.49 76.33 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.994 3.129 . . . . 0.0 118.699 -164.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -115.48 11.97 16.1 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -76.01 134.73 71.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 O-C-N 121.57 -0.706 . . . . 0.0 110.479 170.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -55.54 -25.56 50.19 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.638 2.892 . . . . 0.0 113.932 175.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.0 p -55.01 -44.71 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 C-N-CA 125.339 1.456 . . . . 0.0 113.687 -175.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.04 -36.61 91.04 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -69.24 -36.68 77.44 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.122 0.969 . . . . 0.0 111.673 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.7 t -64.42 -42.91 95.78 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.361 -0.837 . . . . 0.0 112.278 172.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -75.43 -24.27 57.04 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -72.78 -37.43 67.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.212 1.005 . . . . 0.0 112.095 168.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.96 89.34 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.069 -1.019 . . . . 0.0 111.829 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.493 ' SD ' ' HE2' ' A' ' 50' ' ' LYS . 33.3 tpp -62.28 -45.53 92.84 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 112.135 171.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.26 -43.4 78.68 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.498 -0.751 . . . . 0.0 112.317 173.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.82 -41.03 92.32 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.699 0.8 . . . . 0.0 112.683 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 43.0 pt -68.85 -35.67 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.407 1.458 . . . . 0.0 112.287 172.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.2 OUTLIER -74.05 4.73 5.08 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 173.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.9 mt -122.19 3.55 9.82 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 128.26 2.624 . . . . 0.0 113.425 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.1 14.23 77.46 Favored Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.57 47.19 1.06 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.239 1.816 . . . . 0.0 111.86 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -60.05 -34.77 73.87 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.987 -1.071 . . . . 0.0 112.845 -171.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.32 -25.55 68.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.627 1.171 . . . . 0.0 112.532 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -81.29 -41.18 22.53 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.437 0.562 . . . . 0.0 111.054 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.76 88.54 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -175.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.2 pt -64.73 -35.15 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.779 0.718 . . . . 0.0 112.498 174.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -72.22 -44.23 63.24 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.782 0.833 . . . . 0.0 111.046 173.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.4 ttm -62.52 -30.02 70.99 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.885 0.874 . . . . 0.0 112.75 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 91.1 m -65.85 -39.14 90.48 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.99 -1.069 . . . . 0.0 112.113 171.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -70.67 -39.87 73.3 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.858 0.863 . . . . 0.0 112.077 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.07 -35.59 77.36 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.361 0.664 . . . . 0.0 111.529 166.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.22 -31.21 78.48 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 120.539 -1.351 . . . . 0.0 113.279 175.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 98.2 mt -63.56 -29.18 70.47 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.032 1.416 . . . . 0.0 112.808 173.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -66.39 -8.03 23.03 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 170.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -102.68 11.59 37.48 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.036 1.735 . . . . 0.0 112.606 168.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.8 p -126.97 19.28 7.1 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.568 1.547 . . . . 0.0 113.932 -178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 m -81.8 3.83 24.44 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.897 1.279 . . . . 0.0 113.725 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -143.26 150.56 39.44 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 111.328 -166.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.2 -26.1 37.11 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.945 2.202 . . . . 0.0 116.945 -161.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -74.61 -4.81 39.34 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.736 1.153 . . . . 0.0 113.97 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -135.51 11.78 3.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.787 1.235 . . . . 0.0 113.908 -168.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.01 -9.36 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 O-C-N 120.322 -1.486 . . . . 0.0 114.94 -175.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.93 24.52 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.39 0.996 . . . . 0.0 110.459 158.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mm -62.28 -27.89 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 O-C-N 120.866 -1.146 . . . . 0.0 112.041 174.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -48.35 -38.88 20.32 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.727 1.211 . . . . 0.0 112.438 168.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.7 m -79.36 -35.34 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.225 1.01 . . . . 0.0 113.465 170.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.433 ' HE2' ' SD ' ' B' ' -4' ' ' MET 0.272 20.9 ttpt -73.69 9.66 1.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 170.464 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.89 -32.05 7.43 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.723 -1.236 . . . . 0.0 112.855 152.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -81.89 -31.39 31.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.706 ' HH ' ' HD2' ' B' ' 0' ' ' ASP . 0.1 OUTLIER -65.51 -36.15 82.99 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 121.07 1.759 . . . . 0.0 110.191 163.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.414 HH22 ' CD ' ' B' ' -2' ' ' GLU . 10.8 tpp180 -63.55 -35.59 80.98 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.521 1.128 . . . . 0.0 111.446 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 21.3 tp -64.18 -45.04 90.11 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.014 1.325 . . . . 0.0 112.576 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -63.57 -32.53 74.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.058 -1.026 . . . . 0.0 113.062 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.9 -29.07 32.54 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.516 1.527 . . . . 0.0 112.499 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.02 -44.82 75.63 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.536 -1.352 . . . . 0.0 111.182 168.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -57.7 -27.34 62.84 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.793 0.837 . . . . 0.0 111.657 165.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.27 -61.8 6.26 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 128.885 3.136 . . . . 0.0 113.234 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.14 -31.28 68.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.866 1.266 . . . . 0.0 113.268 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.8 p -75.43 -29.96 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.462 0.574 . . . . 0.0 111.742 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -75.9 -109.33 0.12 Allowed Glycine 0 CA--C 1.53 1.026 0 C-N-CA 125.304 1.43 . . . . 0.0 111.949 171.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.7 m 58.95 31.61 21.5 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.76 1.224 . . . . 0.0 114.201 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -96.13 117.63 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 120.703 -1.248 . . . . 0.0 109.5 169.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -76.16 149.12 37.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.829 0.851 . . . . 0.0 112.554 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 59.1 mt 62.11 88.49 0.12 Allowed Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 126.157 1.783 . . . . 0.0 110.407 -168.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.4 -9.83 10.14 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.0 114.197 -175.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.9 t 55.56 69.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 123.133 1.444 . . . . 0.0 112.847 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.3 m -136.39 153.53 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 126.675 1.99 . . . . 0.0 109.586 -178.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.12 -47.13 84.09 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.583 0.629 . . . . 0.0 112.66 -167.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 m -145.72 140.71 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 126.964 2.106 . . . . 0.0 109.198 165.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -165.8 -128.91 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.942 1.297 . . . . 0.0 109.489 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -109.03 -43.83 4.1 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.904 1.682 . . . . 0.0 112.603 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.4 mp 56.58 -178.92 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 176.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -57.23 163.84 7.55 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 121.965 1.777 . . . . 0.0 114.028 170.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -62.76 124.39 20.9 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.816 -1.178 . . . . 0.0 111.837 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.72 -1.76 61.27 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.627 1.584 . . . . 0.0 115.831 -176.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -71.25 -53.26 14.94 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.037 1.419 . . . . 0.0 113.783 -169.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -151.05 113.79 4.7 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.218 1.008 . . . . 0.0 113.529 169.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -111.97 21.44 15.93 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.706 2.002 . . . . 0.0 113.471 -174.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 68.1 m . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.49 1.916 . . . . 0.0 112.119 -158.988 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.433 ' SD ' ' HE2' ' A' ' 79' ' ' LYS . 10.2 ttt . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.61 157.06 38.15 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -156.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.474 ' HE2' ' HZ1' ' A' ' 8' ' ' LYS . 11.8 pt-20 -149.86 179.31 8.14 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.593 2.357 . . . . 0.0 109.832 163.337 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 39.2 t -84.65 103.02 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 O-C-N 120.462 -1.399 . . . . 0.0 111.434 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . 0.706 ' HD2' ' HH ' ' A' ' 82' ' ' TYR . 35.4 m-20 . . . . . 0 C--O 1.254 1.333 0 C-N-CA 127.304 2.242 . . . . 0.0 113.996 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.6 mtt . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -63.43 -39.11 93.6 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -162.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.41 -30.69 71.73 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.928 1.24 . . . . 0.0 112.337 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.37 -39.31 59.33 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.308 9.7 pt-20 -75.75 -10.0 59.06 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.33 0.968 . . . . 0.0 112.941 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -75.13 -57.53 3.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.254 1.422 . . . . 0.0 111.656 156.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -65.07 -34.93 79.59 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -167.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -65.18 -19.87 66.18 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -105.69 -21.36 13.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.616 1.566 . . . . 0.0 113.178 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -55.45 -34.73 64.75 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.158 1.345 . . . . 0.0 111.334 163.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -57.79 -28.96 61.02 Favored Glycine 0 CA--C 1.539 1.59 0 CA-C-O 119.016 -0.88 . . . . 0.0 114.724 172.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -60.76 -49.79 76.09 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.752 1.776 . . . . 0.0 111.87 174.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.5 t -68.92 -30.0 68.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.718 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 76.6 mt -64.31 -41.49 96.8 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.573 -1.329 . . . . 0.0 112.172 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -61.1 -34.94 75.75 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.376 -0.827 . . . . 0.0 112.643 168.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.2 -22.85 51.74 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -78.33 -26.31 46.8 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.436 1.094 . . . . 0.0 111.867 164.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.2 14.16 39.89 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.407 1.003 . . . . 0.0 113.951 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.43 58.62 4.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 127.228 2.211 . . . . 0.0 109.367 178.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -57.47 -36.45 71.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.782 0.833 . . . . 0.0 112.911 -172.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -79.86 -28.5 40.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.532 1.06 . . . . 0.0 111.553 -176.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -69.49 -38.11 77.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.664 0.785 . . . . 0.0 112.412 163.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -32.93 74.3 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 176.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.6 t -69.01 -38.97 79.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.138 0.975 . . . . 0.0 111.033 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -60.73 -33.77 73.41 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.141 -0.974 . . . . 0.0 113.002 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 p -74.01 -34.86 64.31 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 117.763 -1.113 . . . . 0.0 113.942 173.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.251 0.2 OUTLIER -67.09 -33.92 76.51 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.136 1.789 . . . . 0.0 111.693 169.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -62.53 -28.34 69.78 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.413 -0.804 . . . . 0.0 111.892 175.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -68.36 -33.8 74.93 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.709 -1.244 . . . . 0.0 112.539 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.63 -44.27 62.16 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.881 0.764 . . . . 0.0 109.19 177.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -70.85 -20.63 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.073 0.949 . . . . 0.0 112.103 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.5 m -68.63 -39.83 80.6 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.416 -1.428 . . . . 0.0 111.431 168.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -90.3 -28.22 18.91 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -177.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -132.29 60.26 49.64 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 126.151 1.78 . . . . 0.0 111.96 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -59.86 -26.56 82.66 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.195 2.596 . . . . 0.0 115.983 -170.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -106.97 4.44 27.17 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.492 1.517 . . . . 0.0 112.339 -170.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -93.13 130.32 36.4 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 120.813 -1.179 . . . . 0.0 112.969 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.41 -24.05 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.754 2.303 . . . . 0.0 114.107 174.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.49 -30.33 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 173.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.62 -42.35 55.01 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.357 -0.839 . . . . 0.0 111.121 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.45 -29.87 61.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 26.5 p -66.15 -42.9 88.42 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.105 1.321 . . . . 0.0 111.206 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -67.9 -44.51 76.81 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.475 0.71 . . . . 0.0 111.479 176.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -59.22 -41.91 89.76 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.851 0.86 . . . . 0.0 112.399 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.81 -37.29 86.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.379 0.991 . . . . 0.0 112.505 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.6 tpt -70.02 -39.58 75.71 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.626 0.648 . . . . 0.0 111.927 175.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.73 99.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.756 0.822 . . . . 0.0 111.735 172.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.84 -45.04 93.65 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.581 -0.699 . . . . 0.0 111.506 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 29.3 pt -68.44 -30.45 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.028 1.286 . . . . 0.0 112.87 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -11.37 59.85 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 175.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.6 tt -88.97 -29.08 19.79 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.07 1.748 . . . . 0.0 111.084 164.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 107.27 15.42 15.89 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.687 1.613 . . . . 0.0 114.695 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.93 48.71 1.06 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.312 2.245 . . . . 0.0 110.751 -178.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -59.85 -32.6 70.85 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.67 -1.269 . . . . 0.0 112.974 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 55.4 m -55.82 -31.35 62.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.162 1.785 . . . . 0.0 112.787 171.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -79.5 -39.08 32.9 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.669 0.788 . . . . 0.0 111.206 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.43 -39.61 89.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.869 0.868 . . . . 0.0 112.758 -176.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -65.2 -30.54 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.262 0.937 . . . . 0.0 112.912 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -77.35 -36.23 53.96 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.988 0.915 . . . . 0.0 111.698 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.9 ttm -66.65 -30.97 71.36 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 0.0 112.561 173.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 86.8 m -61.92 -43.16 99.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.321 -0.862 . . . . 0.0 111.927 171.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -65.94 -40.0 90.97 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.756 1.223 . . . . 0.0 112.916 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.26 -27.68 69.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.153 0.581 . . . . 0.0 112.312 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -22.17 61.25 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 120.606 -1.309 . . . . 0.0 114.717 174.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.582 ' CD2' HE22 ' A' ' 81' ' ' GLN . 42.4 mt -59.21 -27.35 65.65 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.847 1.824 . . . . 0.0 112.263 171.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -59.88 -10.76 4.33 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.397 1.879 . . . . 0.0 115.458 174.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -124.28 42.0 3.36 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.331 1.853 . . . . 0.0 112.712 -168.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.2 p -129.88 -12.68 4.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -164.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 60.4 m -81.64 49.46 1.33 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -168.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.2 t -164.07 153.35 13.96 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.904 1.681 . . . . 0.0 110.518 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.77 -11.08 32.73 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 120.993 -1.067 . . . . 0.0 113.139 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.49 -31.82 73.09 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.618 1.167 . . . . 0.0 111.932 165.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -130.87 16.87 5.19 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.238 1.415 . . . . 0.0 113.82 -169.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.6 p -69.98 -28.1 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 120.505 -1.372 . . . . 0.0 113.069 178.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.65 -34.99 22.93 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.36 0.664 . . . . 0.0 111.294 170.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 12.8 mm -51.38 -41.72 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 121.468 -0.77 . . . . 0.0 111.052 166.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -55.26 -47.33 75.62 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.847 0.749 . . . . 0.0 111.533 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.6 m -61.86 -42.29 98.87 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.975 1.31 . . . . 0.0 111.875 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -70.32 -4.02 20.13 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.577 1.551 . . . . 0.0 114.153 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -102.76 -31.62 10.23 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.8 1.182 . . . . 0.0 112.983 157.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.582 HE22 ' CD2' ' A' ' 65' ' ' LEU . 10.7 mm-40 -61.12 -53.59 55.14 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.837 1.653 . . . . 0.0 112.079 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -33.65 68.59 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.288 0.495 . . . . 0.0 111.105 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 tpp85 -66.3 -33.2 75.21 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.678 1.191 . . . . 0.0 111.684 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tt -66.82 -50.78 61.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.39 0.676 . . . . 0.0 110.445 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.03 -37.16 71.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 177.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.32 -26.35 35.7 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.925 1.29 . . . . 0.0 112.689 178.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.71 -42.62 90.89 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.743 1.61 . . . . 0.0 110.484 169.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.51 -29.54 70.57 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.453 0.701 . . . . 0.0 111.274 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.93 -60.33 8.61 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 127.756 2.598 . . . . 0.0 113.694 172.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.61 -27.24 68.51 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.419 1.887 . . . . 0.0 113.027 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p -93.68 -18.21 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.03 27.41 53.12 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.547 1.07 . . . . 0.0 114.703 -178.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.1 m -78.19 89.74 4.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.734 1.267 . . . . 0.0 111.202 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 13.0 p -148.16 148.88 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 125.283 1.433 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -135.57 173.72 11.4 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.577 . . . . 0.0 110.966 173.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.5 mt 47.83 65.43 7.04 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.954 1.702 . . . . 0.0 110.516 -174.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -83.24 -0.02 9.74 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.41 2.074 . . . . 0.0 113.059 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 t 53.26 49.56 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.233 1.413 . . . . 0.0 112.617 176.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 27.3 m -130.72 41.75 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 126.534 1.934 . . . . 0.0 111.051 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . 0.259 3.4 mp0 67.84 171.27 0.27 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 128.436 2.695 . . . . 0.0 115.922 174.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.35 -8.08 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -159.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -84.14 -8.2 59.16 Favored 'General case' 0 CA--C 1.553 1.091 0 O-C-N 120.512 -1.368 . . . . 0.0 112.161 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -130.47 -14.24 3.74 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 173.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 88.3 mt -64.7 164.13 22.95 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 120.877 -1.139 . . . . 0.0 111.949 165.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -56.01 151.86 39.8 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.335 2.69 . . . . 0.0 113.843 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -63.69 120.75 12.41 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.297 -0.877 . . . . 0.0 111.266 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.17 -6.31 79.92 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.628 1.585 . . . . 0.0 115.898 -174.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -87.14 128.86 35.12 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.86 1.83 . . . . 0.0 111.842 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.0 t0 56.79 172.79 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.235 1.814 . . . . 0.0 114.763 -174.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -142.52 152.78 43.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.255 1.822 . . . . 0.0 111.86 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.251 1.136 0 C-N-CA 126.061 1.744 . . . . 0.0 111.551 172.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -73.6 -0.82 16.45 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.616 1.709 . . . . 0.0 115.616 -173.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 61.37 -118.31 0.71 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.352 1.861 . . . . 0.0 112.374 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 54.8 t -133.62 90.23 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.467 1.507 . . . . 0.0 108.457 -170.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . 0.323 0.2 OUTLIER . . . . . 0 C--O 1.254 1.304 0 C-N-CA 128.213 2.605 . . . . 0.0 115.277 -172.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.876 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.6 p -67.94 -22.63 65.04 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.051 -1.655 . . . . 0.0 114.051 -176.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -65.04 -39.29 93.13 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.469 1.031 . . . . 0.0 111.309 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -15.42 60.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 174.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.665 ' HE2' ' HA ' ' B' ' -4' ' ' MET . 25.2 mm-40 -75.49 -50.89 14.33 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.756 -1.215 . . . . 0.0 111.429 164.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.276 0.0 OUTLIER -67.22 -29.4 69.04 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.853 1.206 . . . . 0.0 113.658 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.34 -39.14 71.51 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.023 1.283 . . . . 0.0 112.764 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -65.99 -20.44 66.19 Favored 'General case' 0 N--CA 1.485 1.289 0 O-C-N 120.886 -1.134 . . . . 0.0 113.111 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -95.54 -32.44 12.84 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.096 0.958 . . . . 0.0 112.568 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -59.07 -42.94 91.55 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.253 1.021 . . . . 0.0 111.045 170.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.6 -39.65 61.12 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-N 118.82 0.736 . . . . 0.0 113.753 173.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -70.1 -39.9 75.24 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.607 1.204 . . . . 0.0 111.178 177.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.3 t -60.29 -43.08 96.58 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 122.782 0.433 . . . . 0.0 111.426 172.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.8 mt -59.38 -40.66 87.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.222 -0.924 . . . . 0.0 111.652 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.141 1.337 . . . . 0.0 113.022 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.444 ' N ' ' HE2' ' A' ' 16' ' ' LYS . 1.1 mpmm? -68.11 -18.21 64.58 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 175.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -91.89 -7.14 50.08 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.912 1.285 . . . . 0.0 113.124 166.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.21 9.22 86.84 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 121.136 -0.977 . . . . 0.0 114.965 -175.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.0 mt -80.23 46.86 0.86 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.888 2.075 . . . . 0.0 111.893 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -50.7 -41.68 56.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.012 1.725 . . . . 0.0 113.431 -173.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -73.28 -27.4 61.54 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.288 0.949 . . . . 0.0 111.76 -175.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -81.88 -36.07 28.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.507 0.723 . . . . 0.0 111.065 170.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.24 71.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.624 1.17 . . . . 0.0 113.079 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.7 t -56.98 -40.86 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.771 1.228 . . . . 0.0 110.922 177.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.61 -42.07 98.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.538 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -61.26 -46.21 91.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 0.0 112.149 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -65.46 -33.23 75.45 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -69.62 -28.04 65.58 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.708 0.686 . . . . 0.0 112.362 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -66.42 -31.65 72.54 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.525 1.057 . . . . 0.0 112.096 173.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.3 mt -58.3 -37.7 75.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.423 1.011 . . . . 0.0 111.209 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -79.51 -22.92 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 122.711 0.405 . . . . 0.0 111.888 177.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -69.77 -41.46 75.14 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.798 -1.189 . . . . 0.0 111.083 169.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.21 -34.54 23.9 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -176.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -124.67 66.56 47.52 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 125.345 1.458 . . . . 0.0 112.697 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -58.39 -22.4 58.31 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.632 2.888 . . . . 0.0 119.01 -166.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -122.23 16.3 10.65 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.54 1.064 . . . . 0.0 112.653 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -89.5 124.29 64.65 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 111.215 174.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.24 -16.35 53.9 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.417 2.078 . . . . 0.0 113.949 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.4 p -51.58 -46.77 37.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.56 1.073 . . . . 0.0 111.892 171.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.26 -43.42 92.95 Favored Glycine 0 C--N 1.34 0.766 0 C-N-CA 123.522 0.582 . . . . 0.0 111.934 -176.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -58.89 -37.81 77.44 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 117.611 0.705 . . . . 0.0 112.431 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.4 p -65.35 -38.05 88.93 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.774 -1.204 . . . . 0.0 112.886 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.57 HD21 ' HE2' ' B' ' -2' ' ' GLU . 27.2 m120 -76.02 -37.11 58.79 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.83 0.852 . . . . 0.0 111.995 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.18 -33.46 70.01 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.9 -1.125 . . . . 0.0 112.505 175.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.43 83.49 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 120.922 -1.112 . . . . 0.0 111.717 166.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.4 tpt -63.35 -43.45 97.67 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.128 0.571 . . . . 0.0 111.812 173.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.16 -44.78 83.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.084 0.954 . . . . 0.0 112.1 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -64.18 -34.25 77.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.75 0.82 . . . . 0.0 112.848 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.3 pt -80.54 -17.14 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.735 1.152 . . . . 0.0 114.07 171.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.41 -13.13 53.03 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.466 1.506 . . . . 0.0 113.222 171.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 tt -101.82 -38.68 7.74 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.914 2.086 . . . . 0.0 112.077 173.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.19 22.44 5.88 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 124.726 1.155 . . . . 0.0 115.678 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -103.75 53.89 0.75 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.598 1.19 . . . . 0.0 109.094 169.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.51 -34.0 66.57 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 112.83 -173.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.9 m -64.82 -26.34 68.3 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.89 0.768 . . . . 0.0 112.144 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -75.62 -33.4 60.51 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.034 -1.041 . . . . 0.0 112.015 169.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.0 -40.59 71.76 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 112.75 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 25.4 pt -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.938 0.79 . . . . 0.0 112.068 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -62.38 -46.83 86.85 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.882 0.873 . . . . 0.0 110.985 170.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 50.3 ttm -62.2 -32.28 72.91 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.59 -0.693 . . . . 0.0 112.834 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.73 -49.53 62.13 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.051 -1.031 . . . . 0.0 112.031 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.43 -33.96 77.17 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 122.971 0.509 . . . . 0.0 111.811 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -26.37 68.03 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.462 1.505 . . . . 0.0 113.349 169.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.44 -31.55 37.06 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 120.335 -1.478 . . . . 0.0 114.11 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.0 -32.01 70.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.611 1.705 . . . . 0.0 112.161 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -52.77 -22.63 5.53 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.48 1.512 . . . . 0.0 114.581 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -81.42 -12.83 58.81 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.439 1.495 . . . . 0.0 114.145 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -103.03 10.57 38.04 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 118.188 2.662 . . . . 0.0 118.188 -148.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -76.71 37.24 0.17 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.5 t -151.59 148.55 28.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.591 1.556 . . . . 0.0 111.278 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.31 -15.47 16.24 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 172.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -67.77 -26.83 66.31 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.174 0.897 . . . . 0.0 112.111 169.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -128.03 17.09 6.72 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.683 1.593 . . . . 0.0 113.665 -174.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.2 p -63.42 -31.17 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 120.093 -1.63 . . . . 0.0 112.595 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.02 -10.5 59.77 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.02 1.328 . . . . 0.0 113.756 174.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.3 mm -84.3 -35.85 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.829 1.251 . . . . 0.0 110.339 168.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -57.2 -39.35 75.24 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.694 1.198 . . . . 0.0 111.731 176.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.2 p -71.14 -47.5 57.49 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.082 0.953 . . . . 0.0 112.544 171.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.464 ' HZ3' ' HE2' ' B' ' -3' ' ' GLU . 33.7 mttm -48.56 -57.26 6.45 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.403 1.002 . . . . 0.0 111.838 176.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.15 -30.07 67.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 117.979 -1.01 . . . . 0.0 112.976 -173.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -76.55 -38.06 55.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.651 1.569 . . . . 0.0 113.602 175.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.23 -39.2 65.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.703 1.138 . . . . 0.0 111.321 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.93 HH12 ' HE2' ' B' ' -2' ' ' GLU 0.369 15.6 ptp180 -77.04 -11.24 59.78 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.448 1.476 . . . . 0.0 114.412 176.152 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.5 -41.44 55.32 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.248 1.019 . . . . 0.0 112.171 161.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.62 -39.19 83.45 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.104 -0.998 . . . . 0.0 111.343 167.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.47 -28.05 41.54 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.394 1.078 . . . . 0.0 113.572 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.72 89.07 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.751 1.16 . . . . 0.0 110.986 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.0 -26.96 68.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.839 0.856 . . . . 0.0 111.423 170.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.28 -49.65 55.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.728 2.109 . . . . 0.0 114.421 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.99 -27.14 61.62 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.611 -0.935 . . . . 0.0 112.562 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p -90.16 -12.17 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 177.45 164.46 31.03 Favored Glycine 0 CA--C 1.541 1.698 0 C-N-CA 124.518 1.056 . . . . 0.0 114.234 174.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.8 m -128.88 3.45 5.37 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -169.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 13.6 p -111.33 118.54 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.247 1.019 . . . . 0.0 109.411 161.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.62 72.07 1.38 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.141 1.377 . . . . 0.0 111.667 -161.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.2 mt -79.07 115.04 49.57 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 168.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.73 -13.68 27.0 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.517 2.812 . . . . 0.0 113.392 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . 0.302 30.8 m 53.47 21.75 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 116.843 2.164 . . . . 0.0 116.843 174.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 97.6 t -133.79 -22.92 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 125.273 1.429 . . . . 0.0 114.086 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -170.71 168.16 7.52 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.777 1.631 . . . . 0.0 113.589 179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 60.8 t -80.89 88.88 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 126.728 2.011 . . . . 0.0 109.583 162.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -118.21 -69.69 0.84 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.836 1.254 . . . . 0.0 111.555 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -107.2 -60.2 1.72 Allowed 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.613 -0.68 . . . . 0.0 110.416 173.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.9 mt 61.91 166.25 0.1 Allowed Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.839 2.056 . . . . 0.0 113.637 -175.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.74 169.59 19.8 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 121.99 1.794 . . . . 0.0 113.497 160.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -64.85 131.87 47.91 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.037 0.935 . . . . 0.0 112.307 172.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.61 -0.65 89.5 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.88 1.229 . . . . 0.0 115.931 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -89.82 -32.46 16.91 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.943 1.372 . . . . 0.0 112.918 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -149.15 170.34 18.64 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.877 1.671 . . . . 0.0 108.01 156.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -129.6 151.66 49.97 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -170.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.757 2.023 . . . . 0.0 112.995 -170.17 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' -4' ' ' MET . . . . . 0.665 ' HA ' ' HE2' ' A' ' 5' ' ' GLU . 63.7 mtt . . . . . 0 N--CA 1.481 1.092 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.207 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . 0.464 ' HE2' ' HZ3' ' A' ' 79' ' ' LYS . 81.5 mm-40 -91.93 136.66 32.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.997 0.919 . . . . 0.0 112.673 -168.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.93 ' HE2' HH12 ' A' ' 83' ' ' ARG . 3.4 mp0 -78.36 146.83 34.43 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.545 1.138 . . . . 0.0 113.387 -175.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 2.7 p -100.22 176.17 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.856 1.662 . . . . 0.0 113.195 -177.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 24.8 t0 . . . . . 0 C--O 1.252 1.231 0 C-N-CA 127.929 2.492 . . . . 0.0 113.97 -172.459 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 m -51.31 -23.9 4.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -173.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 mp0 -44.77 -36.45 3.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.52 1.528 . . . . 0.0 114.012 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -34.52 26.13 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.614 1.097 . . . . 0.0 112.981 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -64.06 -23.51 67.35 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.502 1.521 . . . . 0.0 112.535 167.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.85 -46.34 25.07 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 125.962 1.705 . . . . 0.0 111.314 171.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -70.51 -27.25 64.04 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -62.53 -29.19 70.39 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 119.303 0.956 . . . . 0.0 112.967 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -85.83 -30.21 23.15 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 172.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.13 -43.88 91.99 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.983 -1.073 . . . . 0.0 111.091 171.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.22 91.44 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-O 119.231 -0.76 . . . . 0.0 114.079 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -55.21 -54.05 48.32 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.551 1.175 . . . . 0.0 110.358 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.6 t -57.86 -43.69 86.13 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.406 1.082 . . . . 0.0 112.166 177.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.33 -33.07 73.0 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.211 -0.931 . . . . 0.0 112.937 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -66.16 -40.04 90.24 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.844 1.202 . . . . 0.0 113.131 171.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -61.53 -40.43 94.63 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.708 -0.62 . . . . 0.0 112.151 173.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -18.85 64.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.417 1.265 . . . . 0.0 114.417 171.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.99 11.93 69.21 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 123.94 0.781 . . . . 0.0 114.864 -176.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.4 mt -89.03 57.52 4.15 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.234 1.814 . . . . 0.0 109.903 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -56.8 -39.24 73.77 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.939 1.295 . . . . 0.0 114.056 -170.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -83.33 -27.99 29.36 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.124 0.874 . . . . 0.0 111.582 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -70.74 -33.2 70.57 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.175 0.443 . . . . 0.0 111.925 164.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.31 -49.11 68.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.661 0.664 . . . . 0.0 111.803 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.3 t -59.05 -37.03 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.981 -1.009 . . . . 0.0 111.02 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -54.99 -42.14 72.09 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.859 1.209 . . . . 0.0 112.912 174.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.3 m -66.46 -37.06 84.3 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.091 0.859 . . . . 0.0 112.685 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -75.06 -38.27 61.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -64.23 -35.72 81.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.26 0.624 . . . . 0.0 110.636 173.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -23.31 66.4 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 173.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.3 mt -60.61 -42.17 96.29 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.146 1.339 . . . . 0.0 109.46 168.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.1 mt -82.95 -28.6 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.4 1.48 . . . . 0.0 112.147 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -58.5 -32.87 69.2 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.662 -1.274 . . . . 0.0 111.512 168.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -89.61 -29.09 19.09 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 175.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -136.16 68.85 63.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 124.987 1.315 . . . . 0.0 110.774 -168.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -61.29 -36.8 77.53 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.291 1.994 . . . . 0.0 115.552 -163.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.37 6.8 38.94 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -174.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -105.24 130.49 23.01 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -158.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.49 -17.31 53.09 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.555 2.17 . . . . 0.0 113.414 168.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.78 2.44 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.613 1.565 . . . . 0.0 114.7 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -116.6 -36.97 1.02 Allowed Glycine 0 CA--C 1.531 1.09 0 O-C-N 121.5 -0.75 . . . . 0.0 112.679 155.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -60.29 -44.05 95.72 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.036 1.418 . . . . 0.0 112.881 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.4 p -67.8 -27.36 66.67 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.658 -0.651 . . . . 0.0 112.294 -177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -84.04 -42.24 16.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.495 . . . . 0.0 110.908 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -64.66 -32.12 73.64 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.245 -0.909 . . . . 0.0 112.335 172.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.49 -37.04 85.76 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.125 -0.984 . . . . 0.0 112.633 170.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 tpt -66.14 -38.74 88.87 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.856 0.862 . . . . 0.0 111.735 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.8 -42.35 93.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.409 0.684 . . . . 0.0 111.831 174.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.2 -36.68 84.93 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 118.58 -0.724 . . . . 0.0 112.68 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.3 pt -68.49 -33.84 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.312 1.415 . . . . 0.0 112.37 169.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.79 -12.33 60.02 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 -17.14 38.28 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.917 2.087 . . . . 0.0 111.039 163.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.8 22.09 56.34 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.856 1.217 . . . . 0.0 114.308 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -107.73 57.94 0.62 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.891 1.676 . . . . 0.0 110.123 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -56.21 -36.22 68.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.579 1.552 . . . . 0.0 112.497 -175.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.6 m -62.27 -26.73 68.56 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.387 0.994 . . . . 0.0 112.625 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -84.09 -28.74 27.33 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.511 -0.743 . . . . 0.0 111.93 172.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.16 -36.43 58.75 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.177 0.991 . . . . 0.0 113.298 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -68.17 -32.08 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.023 0.829 . . . . 0.0 111.996 175.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -61.55 -50.48 72.47 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.22 0.608 . . . . 0.0 110.049 166.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.5 ttm -69.09 -32.41 71.82 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -174.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -70.35 -39.59 74.58 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.827 -1.171 . . . . 0.0 112.034 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -73.07 -28.68 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.736 1.153 . . . . 0.0 113.394 171.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -32.12 73.51 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.878 -1.139 . . . . 0.0 111.265 166.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.11 -22.7 73.28 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-O 117.87 -1.516 . . . . 0.0 114.514 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.6 mt -56.84 -29.71 63.08 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.288 2.044 . . . . 0.0 112.313 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -64.7 -1.13 1.71 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.193 1.797 . . . . 0.0 114.516 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -130.41 37.65 3.83 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.553 1.941 . . . . 0.0 111.482 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -129.73 -14.19 4.1 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 -167.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.6 m -80.12 22.4 0.52 Allowed 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -163.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 p -141.33 161.27 38.3 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 119.659 1.118 . . . . 0.0 111.97 -173.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.57 67.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -66.91 -18.22 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.237 1.015 . . . . 0.0 113.068 170.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -126.63 14.89 7.59 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.261 1.424 . . . . 0.0 113.88 -173.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.29 -29.99 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.975 -1.078 . . . . 0.0 113.055 177.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.76 -44.94 54.65 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.067 -1.021 . . . . 0.0 110.886 170.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.87 -35.84 53.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.275 1.43 . . . . 0.0 112.459 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 21.6 ttp-105 -58.83 -39.72 82.06 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.23 1.012 . . . . 0.0 112.219 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -77.7 -39.2 45.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.569 1.148 . . . . 0.0 112.234 172.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -68.59 -16.93 64.02 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -178.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -91.07 -32.09 16.01 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.053 1.297 . . . . 0.0 113.705 163.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -78.55 -42.3 29.68 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.402 1.455 . . . . 0.0 113.319 -175.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -34.86 78.74 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.969 1.259 . . . . 0.0 110.814 171.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.888 HH12 ' HE2' ' B' ' -2' ' ' GLU . 8.1 ttm180 -67.39 -36.93 82.28 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.681 1.593 . . . . 0.0 111.989 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.0 tp -67.96 -39.38 83.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.716 1.206 . . . . 0.0 112.051 170.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.5 -39.89 94.95 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.265 -0.897 . . . . 0.0 112.383 169.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.9 -29.51 62.1 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.981 1.264 . . . . 0.0 112.863 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.47 96.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.96 -1.088 . . . . 0.0 111.169 167.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -69.99 -19.89 63.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.216 1.006 . . . . 0.0 112.566 172.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -65.86 -62.8 4.46 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.819 2.152 . . . . 0.0 112.757 168.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.97 63.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -175.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -71.51 -15.4 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.101 -0.999 . . . . 0.0 112.933 171.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 74.01 37.42 49.98 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.998 0.817 . . . . 0.0 114.539 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 m -50.87 -33.66 24.88 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.841 1.32 . . . . 0.0 113.948 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.36 146.49 28.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.893 1.277 . . . . 0.0 111.402 165.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -139.04 142.91 38.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.565 1.146 . . . . 0.0 112.195 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.5 mt 60.54 89.94 0.1 OUTLIER Pre-proline 0 N--CA 1.477 0.912 0 C-N-CA 126.486 1.915 . . . . 0.0 111.414 178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -74.18 -7.16 19.46 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.0 2.467 . . . . 0.0 113.429 175.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . 0.258 2.2 t 69.15 43.65 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 125.351 1.461 . . . . 0.0 113.363 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -136.9 152.17 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 129.732 3.213 . . . . 0.0 107.417 171.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -60.91 -40.39 92.96 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 120.164 1.347 . . . . 0.0 113.892 -170.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.3 t -138.55 137.72 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 C-N-CA 125.715 1.606 . . . . 0.0 110.776 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -160.45 -77.71 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.789 1.636 . . . . 0.0 109.642 175.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -135.22 -47.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.428 1.491 . . . . 0.0 109.202 158.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 11.0 mp 63.01 164.38 0.11 Allowed Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 128.061 2.544 . . . . 0.0 113.268 173.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.26 161.73 39.22 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 121.52 1.48 . . . . 0.0 111.441 159.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -55.96 134.0 51.96 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.04 1.336 . . . . 0.0 112.799 -174.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.6 -24.76 2.17 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.668 1.604 . . . . 0.0 115.387 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -62.51 -17.26 59.31 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.028 1.414 . . . . 0.0 113.903 -170.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -63.11 -31.56 72.73 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 172.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? 38.57 32.83 0.06 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 127.218 2.207 . . . . 0.0 114.543 -175.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 59.0 m . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.084 1.354 . . . . 0.0 112.185 -169.757 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -163.79 155.79 17.14 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.429 1.491 . . . . 0.0 112.179 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.888 ' HE2' HH12 ' A' ' 83' ' ' ARG . 34.9 tt0 -147.29 -45.15 0.17 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.375 2.27 . . . . 0.0 111.378 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 49.1 t -140.68 147.28 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.822 1.649 . . . . 0.0 109.688 -175.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 124.149 0.979 . . . . 0.0 113.089 177.736 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 tpp . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 119.107 -0.473 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 m -57.48 -25.38 59.66 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 -61.25 -47.99 83.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.871 1.669 . . . . 0.0 111.041 173.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.37 60.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.045 0.938 . . . . 0.0 113.298 176.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.22 -45.13 57.98 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 120.772 -1.205 . . . . 0.0 111.656 165.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -25.63 60.35 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.446 1.475 . . . . 0.0 113.855 178.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -75.58 -26.57 58.03 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.363 0.983 . . . . 0.0 113.274 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -69.33 -39.23 78.32 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.003 -1.061 . . . . 0.0 111.725 170.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.0 -39.06 93.27 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 169.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -59.44 -43.03 93.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.853 0.861 . . . . 0.0 111.479 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.23 -56.15 25.77 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 118.783 0.72 . . . . 0.0 112.183 173.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -54.89 -42.97 72.77 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.942 0.897 . . . . 0.0 111.852 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.8 t -68.88 -38.88 79.96 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.951 1.701 . . . . 0.0 113.43 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.4 mt -65.88 -35.36 80.43 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.779 -1.201 . . . . 0.0 111.322 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -63.3 -40.67 97.99 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.362 0.983 . . . . 0.0 112.269 169.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.06 -33.53 76.0 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.344 -0.847 . . . . 0.0 112.618 177.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.02 -30.82 55.96 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.456 1.102 . . . . 0.0 113.399 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.78 12.36 20.96 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.433 1.492 . . . . 0.0 115.12 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.77 53.79 2.94 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.058 1.743 . . . . 0.0 109.642 174.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -57.61 -36.32 71.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.57 1.148 . . . . 0.0 113.606 -168.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mmt-85 -75.84 -38.37 58.09 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.943 -1.098 . . . . 0.0 111.726 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.78 -31.91 71.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.694 0.397 . . . . 0.0 111.632 172.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.16 98.56 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.04 0.936 . . . . 0.0 112.65 171.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.72 -41.27 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.735 0.814 . . . . 0.0 111.299 173.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.1 m-70 -59.65 -38.46 81.48 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.226 0.921 . . . . 0.0 112.568 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 m -66.28 -26.46 67.34 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 117.72 -1.133 . . . . 0.0 113.573 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.93 -37.49 39.64 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 121.022 1.737 . . . . 0.0 112.261 168.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.87 -29.95 71.14 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.097 0.862 . . . . 0.0 112.094 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -66.64 -36.52 82.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.896 172.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.0 mt -63.8 -41.79 97.84 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.838 1.199 . . . . 0.0 111.217 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.21 -23.09 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.896 0.879 . . . . 0.0 111.019 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.4 m -78.17 -40.81 36.64 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.275 -0.89 . . . . 0.0 111.582 171.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.66 -31.5 24.14 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -129.69 66.39 77.14 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 126.169 1.787 . . . . 0.0 112.02 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -60.01 -26.69 83.11 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 123.297 2.664 . . . . 0.0 116.91 -170.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -106.56 5.86 29.51 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.456 1.503 . . . . 0.0 112.128 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.4 137.63 32.4 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 121.017 -1.052 . . . . 0.0 111.893 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -63.39 -22.78 71.67 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.176 1.917 . . . . 0.0 114.039 176.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.1 p -57.82 -42.09 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.971 1.308 . . . . 0.0 113.702 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.65 -40.39 46.37 Favored Glycine 0 N--CA 1.468 0.829 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -64.3 -37.34 87.14 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.239 1.02 . . . . 0.0 111.769 173.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.4 m -59.39 -30.22 68.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.961 0.904 . . . . 0.0 112.676 172.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.434 HD22 ' HE2' ' B' ' -2' ' ' GLU 0.274 6.0 m120 -103.36 -16.07 15.74 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -176.85 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -65.96 -43.09 88.95 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.187 0.903 . . . . 0.0 110.648 155.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.35 89.26 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.143 -0.973 . . . . 0.0 112.661 170.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.2 tpt -62.61 -44.21 96.88 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.606 0.762 . . . . 0.0 112.324 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -46.03 89.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.178 0.991 . . . . 0.0 111.94 175.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.5 mt -59.45 -38.83 81.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.48 0.712 . . . . 0.0 112.349 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.4 pt -77.51 -27.98 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.758 1.163 . . . . 0.0 112.929 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -12.6 61.02 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 171.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 mt -118.16 -5.94 10.9 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.866 2.066 . . . . 0.0 114.957 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.32 45.37 8.13 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 119.264 0.938 . . . . 0.0 115.319 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -118.04 49.57 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.821 1.649 . . . . 0.0 110.094 169.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.27 -35.05 71.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.474 1.11 . . . . 0.0 112.959 -168.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.6 m -65.01 -31.26 72.4 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.625 1.17 . . . . 0.0 112.52 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -81.36 -31.31 33.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.087 0.555 . . . . 0.0 110.957 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.44 -44.95 85.71 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.712 -0.618 . . . . 0.0 111.621 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.9 pt -63.95 -29.69 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.997 0.817 . . . . 0.0 113.072 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -63.82 -49.62 72.13 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.49 0.716 . . . . 0.0 110.81 168.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 30.1 ttm -69.61 -26.2 64.32 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 71.0 m -60.25 -45.65 92.52 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.437 -0.789 . . . . 0.0 111.307 170.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -71.13 -40.57 71.31 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.461 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.91 -34.1 71.31 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.3 -0.875 . . . . 0.0 111.756 171.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.81 -20.22 74.04 Favored Glycine 0 CA--C 1.533 1.204 0 O-C-N 120.66 -1.275 . . . . 0.0 115.025 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.18 -35.19 73.13 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.971 1.886 . . . . 0.0 111.17 166.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -72.55 -2.56 20.27 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -105.89 -5.12 19.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.953 1.301 . . . . 0.0 112.699 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 74.4 p -137.75 0.97 2.27 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -162.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.4 m -82.04 54.34 2.47 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.613 1.097 . . . . 0.0 111.918 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.6 t -157.94 151.37 23.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.764 1.626 . . . . 0.0 111.867 -175.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -47.96 -31.43 5.26 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.149 1.78 . . . . 0.0 115.312 -177.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -82.83 1.58 38.47 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -145.64 17.8 1.48 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 126.264 1.826 . . . . 0.0 113.625 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -64.34 -25.7 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.643 1.719 . . . . 0.0 115.643 -171.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.96 -20.13 20.27 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.546 1.538 . . . . 0.0 111.859 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.4 mm -70.43 -38.22 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 O-C-N 121.285 -0.884 . . . . 0.0 109.685 163.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -52.96 -43.44 66.38 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.071 0.948 . . . . 0.0 110.66 173.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -57.4 -39.98 77.27 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.613 1.565 . . . . 0.0 113.944 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.29 -47.02 82.55 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.307 1.412 . . . . 0.0 111.765 169.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.12 -32.99 72.77 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 120.037 1.29 . . . . 0.0 113.21 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -62.17 -50.31 72.36 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.374 1.443 . . . . 0.0 110.92 169.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . 0.255 0.0 OUTLIER -71.69 -31.13 66.43 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -173.94 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.76 HH22 ' HE2' ' B' ' -2' ' ' GLU . 3.8 mmt180 -52.37 -43.89 64.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.105 0.866 . . . . 0.0 110.87 165.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.38 -38.59 74.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.936 0.895 . . . . 0.0 111.945 -178.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.84 -34.18 77.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.832 1.253 . . . . 0.0 112.339 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -93.0 -11.93 31.93 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 174.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.35 -54.14 13.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.084 1.311 . . . . 0.0 110.166 165.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -70.07 -22.19 63.08 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 175.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.96 -60.67 5.86 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.316 2.388 . . . . 0.0 114.418 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.75 60.82 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.568 1.184 . . . . 0.0 113.386 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.4 p -77.34 -13.6 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 171.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -161.88 97.54 0.15 Allowed Glycine 0 CA--C 1.533 1.177 0 CA-C-N 119.09 0.859 . . . . 0.0 114.57 171.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.2 m -81.31 77.22 8.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.593 1.957 . . . . 0.0 111.957 -176.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -154.84 130.37 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 126.551 1.94 . . . . 0.0 109.939 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -129.92 -14.25 4.0 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.445 1.498 . . . . 0.0 114.669 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 11.5 mt -92.82 109.84 41.66 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 124.819 1.248 . . . . 0.0 109.024 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -82.38 -4.99 11.82 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.961 3.107 . . . . 0.0 114.077 -178.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 t 56.46 51.55 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.629 1.572 . . . . 0.0 112.372 175.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.4 m -139.65 163.12 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 127.646 2.378 . . . . 0.0 109.481 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -81.32 -22.5 38.48 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -167.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.6 t -142.96 121.35 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.875 0.87 . . . . 0.0 110.874 172.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -162.58 -143.79 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.747 2.019 . . . . 0.0 108.933 173.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -76.01 -53.95 7.59 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 119.906 -1.746 . . . . 0.0 109.812 169.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.1 mt 66.53 162.29 0.13 Allowed Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.401 1.88 . . . . 0.0 114.502 169.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -60.96 167.55 8.67 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.344 2.696 . . . . 0.0 112.251 162.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.18 -25.89 58.61 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -170.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -115.7 97.23 0.78 Allowed Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.908 1.718 . . . . 0.0 110.984 172.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -153.52 -166.35 2.39 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.462 1.105 . . . . 0.0 111.568 -173.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -52.98 133.15 38.37 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.831 1.252 . . . . 0.0 113.301 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -161.09 143.37 12.33 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.831 1.252 . . . . 0.0 111.17 168.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 m . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.225 1.41 . . . . 0.0 111.855 171.641 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 8.2 tpt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -147.77 151.93 36.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.771 1.628 . . . . 0.0 111.16 170.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -2' ' ' GLU . . . . . 0.76 ' HE2' HH22 ' A' ' 83' ' ' ARG . 33.8 mt-10 -103.64 152.63 21.55 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 10.5 p -128.72 163.51 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.891 2.076 . . . . 0.0 111.003 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 C--O 1.251 1.182 0 C-N-CA 125.231 1.412 . . . . 0.0 113.353 179.694 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -10.92 60.09 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -88.83 -36.7 15.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.115 1.366 . . . . 0.0 111.92 172.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -80.19 -24.28 40.41 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.42 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.5 -30.2 62.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.371 0.987 . . . . 0.0 112.791 175.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -73.38 -33.03 64.82 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.952 -1.093 . . . . 0.0 112.971 171.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.15 -36.72 83.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.505 0.722 . . . . 0.0 112.614 169.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.48 -44.54 93.03 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.376 -0.827 . . . . 0.0 110.544 168.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.11 -50.53 58.83 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.556 0.598 . . . . 0.0 113.384 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -61.49 -40.71 95.54 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 118.432 1.116 . . . . 0.0 112.011 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -64.14 -36.94 85.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.388 1.075 . . . . 0.0 112.383 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.5 mt -69.8 -39.02 76.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.341 1.057 . . . . 0.0 112.114 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 51.1 m-85 -61.49 -28.51 69.35 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 118.932 0.787 . . . . 0.0 112.533 167.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.8 -7.34 54.2 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -110.98 -31.32 7.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.953 1.301 . . . . 0.0 112.859 172.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.8 9.15 14.48 Favored Glycine 0 N--CA 1.476 1.31 0 C-N-CA 124.216 0.912 . . . . 0.0 114.474 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.84 54.87 3.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.994 1.717 . . . . 0.0 110.293 176.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -57.23 -34.51 68.65 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.008 0.923 . . . . 0.0 113.26 -171.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.23 -32.76 56.06 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.311 1.414 . . . . 0.0 111.845 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.92 -32.97 65.68 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 118.668 0.667 . . . . 0.0 111.969 168.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -67.45 -41.03 85.37 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.905 -1.122 . . . . 0.0 112.298 173.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.4 t -62.02 -39.74 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.545 1.138 . . . . 0.0 110.89 168.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -56.91 -32.47 65.96 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.314 0.961 . . . . 0.0 112.369 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.7 m -71.71 -39.74 69.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.259 -0.877 . . . . 0.0 113.295 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -38.71 75.05 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.301 1.409 . . . . 0.0 111.081 172.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -61.13 -32.17 71.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.107 1.363 . . . . 0.0 111.855 177.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -60.99 -40.08 92.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.671 1.123 . . . . 0.0 112.072 171.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.22 -42.8 88.2 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.774 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.1 mt -76.18 -22.52 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.123 0.969 . . . . 0.0 111.188 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 55.6 m -67.96 -41.92 81.68 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.891 -1.756 . . . . 0.0 111.222 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.32 -20.9 26.13 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.83 65.22 37.76 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.655 1.582 . . . . 0.0 110.809 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -61.93 -22.95 75.31 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.581 2.854 . . . . 0.0 117.27 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -123.33 10.68 9.28 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.42 1.488 . . . . 0.0 111.27 -170.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -90.64 131.77 36.94 Favored Pre-proline 0 CA--C 1.544 0.737 0 O-C-N 120.574 -1.329 . . . . 0.0 111.292 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.75 -17.46 60.01 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.683 2.255 . . . . 0.0 114.065 177.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.7 p -53.55 -42.67 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 119.028 0.831 . . . . 0.0 111.926 170.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.55 -37.97 85.81 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.18 -0.95 . . . . 0.0 111.624 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -69.84 -35.24 74.6 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.556 0.742 . . . . 0.0 112.64 175.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.6 t -61.26 -36.77 80.92 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.073 -1.017 . . . . 0.0 112.469 170.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -77.97 -28.49 49.43 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.513 0.725 . . . . 0.0 112.57 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -68.17 -41.94 80.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.873 1.215 . . . . 0.0 111.65 166.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.07 81.44 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.119 -0.988 . . . . 0.0 112.404 173.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -61.53 -49.41 76.82 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.269 1.028 . . . . 0.0 111.457 169.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.57 82.35 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.258 0.623 . . . . 0.0 112.221 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.3 mt -62.08 -42.85 99.63 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.894 0.878 . . . . 0.0 112.598 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.14 -20.73 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 119.55 1.068 . . . . 0.0 113.123 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.24 -8.27 56.99 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.604 1.162 . . . . 0.0 114.061 172.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.4 7.79 21.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.68 1.992 . . . . 0.0 112.735 170.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.16 17.98 79.65 Favored Glycine 0 CA--C 1.535 1.343 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 174.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -104.28 52.83 0.75 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.848 1.659 . . . . 0.0 110.75 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.64 -29.89 64.94 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.101 1.36 . . . . 0.0 112.683 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 m -62.99 -27.67 69.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.679 0.792 . . . . 0.0 112.506 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -77.02 -40.86 44.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.176 0.898 . . . . 0.0 111.299 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.09 93.22 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.385 -0.822 . . . . 0.0 113.005 -175.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.7 pt -63.88 -30.66 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -78.24 -45.56 22.61 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.6 171.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.9 ttm -65.13 -28.87 69.72 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.162 -0.961 . . . . 0.0 113.083 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.9 m -66.42 -39.93 89.25 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.99 -1.069 . . . . 0.0 112.295 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -62.71 -45.73 91.37 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.036 0.835 . . . . 0.0 110.391 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.99 -37.06 68.61 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.87 -23.65 59.32 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.224 1.375 . . . . 0.0 115.066 177.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.74 -18.93 65.68 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.57 1.685 . . . . 0.0 112.416 171.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -72.14 5.01 3.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.443 1.497 . . . . 0.0 114.829 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -121.35 44.18 2.61 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.475 1.91 . . . . 0.0 111.037 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.0 p -132.13 -2.19 3.6 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -164.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 81.6 p -63.93 -15.85 60.1 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 -164.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 p -120.17 165.97 14.06 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 120.586 1.539 . . . . 0.0 113.7 -173.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.82 -0.86 1.64 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.1 1.36 . . . . 0.0 114.594 174.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -83.32 -17.63 41.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.344 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -129.98 15.09 5.78 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.492 1.517 . . . . 0.0 114.203 -166.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.54 -30.34 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 120.494 -1.379 . . . . 0.0 112.32 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.55 -38.81 81.11 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.176 -0.953 . . . . 0.0 112.086 171.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.2 mm -61.56 -37.93 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.593 1.157 . . . . 0.0 110.687 174.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.09 -44.37 96.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.607 1.163 . . . . 0.0 112.619 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 t -63.78 -48.54 76.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 111.892 167.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.3 ttpt -58.0 -44.43 87.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 112.939 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.05 -24.47 51.98 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.779 1.172 . . . . 0.0 113.794 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.96 -34.2 59.81 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.278 1.399 . . . . 0.0 113.459 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -35.37 58.59 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.116 0.871 . . . . 0.0 111.647 168.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -57.76 -40.58 80.1 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.039 1.29 . . . . 0.0 111.659 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -65.69 -41.76 92.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.933 0.893 . . . . 0.0 112.874 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.817 0.847 . . . . 0.0 111.017 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.21 -20.03 35.37 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.77 -50.88 65.07 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.925 1.239 . . . . 0.0 110.329 164.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.86 -28.25 69.36 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.927 0.891 . . . . 0.0 111.964 171.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.24 -55.68 17.47 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 127.535 2.493 . . . . 0.0 112.591 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.69 76.52 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.986 1.714 . . . . 0.0 112.56 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.3 p . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 175.163 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.61 -30.88 66.29 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.103 -0.998 . . . . 0.0 112.527 177.007 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.45 -28.12 64.77 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.034 1.734 . . . . 0.0 112.48 165.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.34 -45.61 17.49 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.742 0.817 . . . . 0.0 112.9 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -66.28 -27.17 67.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.882 1.219 . . . . 0.0 112.858 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -64.01 -45.93 86.75 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.604 1.093 . . . . 0.0 111.571 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.77 -34.78 60.27 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 -39.8 71.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.958 1.254 . . . . 0.0 111.649 175.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.97 -35.26 91.77 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 120.925 -1.109 . . . . 0.0 112.714 170.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -62.23 -40.46 96.21 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.127 -1.219 . . . . 0.0 112.111 169.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.3 t -63.23 -35.85 81.69 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.513 -0.742 . . . . 0.0 112.151 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.4 mt -65.98 -36.93 84.65 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.606 -1.308 . . . . 0.0 112.482 172.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.73 -33.56 76.15 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.651 1.114 . . . . 0.0 112.228 167.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.9 -2.28 17.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.573 1.549 . . . . 0.0 114.598 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -113.28 -50.74 2.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.495 1.918 . . . . 0.0 112.35 175.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.3 0.23 3.41 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.863 1.22 . . . . 0.0 115.34 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -85.33 51.99 2.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.749 2.42 . . . . 0.0 111.319 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.88 -33.57 70.64 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.987 1.315 . . . . 0.0 113.15 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -68.7 -47.11 67.22 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.927 1.24 . . . . 0.0 110.351 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.41 -36.58 79.31 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.325 0.39 . . . . 0.0 111.41 176.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.16 77.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.318 0.647 . . . . 0.0 112.62 176.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.2 t -62.43 -37.28 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.674 0.79 . . . . 0.0 110.77 174.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -61.02 -39.2 88.85 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.037 0.835 . . . . 0.0 112.651 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -66.04 -40.96 91.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.44 0.696 . . . . 0.0 112.199 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -68.4 -37.31 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.609 -0.682 . . . . 0.0 112.485 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -63.56 -26.14 68.56 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -76.69 -26.89 55.24 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.746 1.157 . . . . 0.0 113.52 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -62.0 -31.2 71.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.096 0.862 . . . . 0.0 110.491 170.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.2 mt -79.75 -41.93 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 124.461 1.105 . . . . 0.0 111.652 173.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 52.3 m -52.51 -42.3 64.2 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.694 1.588 . . . . 0.0 112.057 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -24.59 53.88 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -140.42 57.43 8.68 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.179 1.392 . . . . 0.0 112.781 -169.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -64.31 -23.95 65.34 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.383 2.055 . . . . 0.0 115.731 -166.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -95.15 -14.07 24.48 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.535 1.134 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -88.12 128.16 54.68 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 119.141 0.882 . . . . 0.0 112.675 -172.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -60.88 -22.79 75.26 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.641 2.227 . . . . 0.0 114.05 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.7 -30.77 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.4 1.48 . . . . 0.0 113.607 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -35.58 55.53 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.36 -1.462 . . . . 0.0 112.136 174.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -79.72 -33.85 40.54 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.572 1.149 . . . . 0.0 112.489 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.9 p -62.49 -31.08 71.77 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.223 -0.923 . . . . 0.0 112.24 169.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -77.23 -47.04 21.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.41 1.084 . . . . 0.0 111.607 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -57.53 -35.56 70.45 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.879 1.672 . . . . 0.0 112.552 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.04 89.89 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 169.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 tpt -65.16 -43.25 92.39 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.636 1.175 . . . . 0.0 111.606 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.61 93.51 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.654 0.782 . . . . 0.0 112.368 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.9 mt -58.6 -41.32 85.55 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.217 0.607 . . . . 0.0 112.404 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.25 -33.14 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-N 118.961 0.8 . . . . 0.0 112.699 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -18.16 63.64 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.631 1.173 . . . . 0.0 113.197 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 tt -95.96 -39.6 9.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.345 2.258 . . . . 0.0 111.899 179.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 122.16 16.92 3.81 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.614 1.102 . . . . 0.0 115.715 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -103.02 48.4 0.86 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.746 1.619 . . . . 0.0 110.319 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -55.09 -38.1 67.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.665 1.586 . . . . 0.0 112.147 -174.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.6 m -65.97 -20.44 66.2 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 113.285 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -81.62 -40.26 23.23 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.874 -1.141 . . . . 0.0 110.978 169.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.95 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.5 pt -62.09 -33.04 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.742 0.701 . . . . 0.0 112.632 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.5 tm0? -75.83 -43.94 43.48 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.124 0.569 . . . . 0.0 111.669 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.9 tpp -54.76 -39.04 67.94 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.969 0.804 . . . . 0.0 112.568 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.36 -40.76 91.92 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.196 -0.94 . . . . 0.0 113.018 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -76.12 -28.48 57.48 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.27 1.028 . . . . 0.0 112.482 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.15 -32.47 70.47 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.851 0.86 . . . . 0.0 112.245 166.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.57 -25.45 60.81 Favored Glycine 0 CA--C 1.536 1.364 0 O-C-N 120.321 -1.487 . . . . 0.0 113.942 174.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.86 -21.33 28.54 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.33 1.565 . . . . 0.0 112.958 166.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -72.31 4.23 3.9 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 125.556 1.542 . . . . 0.0 115.032 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -124.09 29.09 6.54 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.468 2.307 . . . . 0.0 111.947 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -127.0 12.12 7.16 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -163.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.1 p -71.55 -7.48 47.89 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -169.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.7 t -132.86 157.12 45.84 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.016 1.726 . . . . 0.0 112.135 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -48.65 -33.07 9.29 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.339 1.855 . . . . 0.0 112.84 173.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -55.94 -19.45 12.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.448 1.499 . . . . 0.0 114.065 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -131.79 17.07 4.73 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 112.453 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.5 p -71.96 -32.47 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 120.066 -1.646 . . . . 0.0 112.891 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.68 -35.32 70.24 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.239 -0.913 . . . . 0.0 111.405 171.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.1 mm -59.84 -37.37 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.988 1.715 . . . . 0.0 112.108 168.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -58.5 -33.61 70.01 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.401 1.0 . . . . 0.0 112.469 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -77.86 -41.59 36.29 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.699 0.8 . . . . 0.0 112.774 167.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -66.34 -16.99 64.5 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -92.83 -36.64 12.73 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.933 1.242 . . . . 0.0 114.051 161.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -73.1 -30.99 64.05 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.773 1.624 . . . . 0.0 113.727 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -31.17 63.89 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.592 1.087 . . . . 0.0 111.531 167.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -63.48 -34.13 77.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.121 -0.987 . . . . 0.0 111.807 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.74 -44.35 96.42 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.111 0.964 . . . . 0.0 112.079 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -68.7 -33.05 73.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.868 1.267 . . . . 0.0 111.943 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.36 -14.51 46.17 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 174.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.85 -46.27 65.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.905 1.684 . . . . 0.0 111.194 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -74.11 -6.49 47.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.75 -49.77 6.36 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.592 1.568 . . . . 0.0 113.66 162.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.89 -27.48 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.028 2.131 . . . . 0.0 113.69 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 124.357 1.063 . . . . 0.0 112.569 169.48 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.15 -38.65 72.23 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.47 -0.769 . . . . 0.0 112.9 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.58 -24.51 64.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.277 1.031 . . . . 0.0 113.379 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -73.53 -63.0 1.29 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.592 1.157 . . . . 0.0 111.378 160.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -60.83 -30.62 70.2 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -163.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -65.55 -37.42 86.65 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.101 0.96 . . . . 0.0 112.942 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -92.41 -31.33 15.34 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.558 1.072 . . . . 0.0 112.122 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -49.37 -39.56 32.56 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.313 1.445 . . . . 0.0 111.674 166.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -52.77 -43.2 60.13 Favored Glycine 0 CA--C 1.537 1.444 0 O-C-N 121.435 -0.791 . . . . 0.0 113.972 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -70.51 -38.78 74.33 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.199 1.499 . . . . 0.0 111.956 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -63.72 -31.94 73.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.278 1.031 . . . . 0.0 112.502 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.83 -37.59 79.26 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.587 -1.321 . . . . 0.0 112.332 175.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.48 -32.61 73.53 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.422 1.01 . . . . 0.0 112.245 165.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.0 10.8 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.53 1.932 . . . . 0.0 114.947 174.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -120.54 -44.55 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.781 1.633 . . . . 0.0 110.732 165.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.69 -1.68 3.61 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.19 1.376 . . . . 0.0 114.821 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.0 mt -87.26 53.56 2.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.466 1.906 . . . . 0.0 111.244 -170.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -53.71 -35.93 61.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.012 1.325 . . . . 0.0 113.36 -173.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -75.21 -33.65 61.4 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.188 0.904 . . . . 0.0 112.176 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -75.44 -29.76 59.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.167 0.894 . . . . 0.0 112.248 168.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.7 -44.55 89.88 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.127 -0.983 . . . . 0.0 111.861 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.9 t -62.83 -42.01 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.928 0.891 . . . . 0.0 111.02 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -54.28 -40.37 67.78 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.63 0.65 . . . . 0.0 112.717 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.9 m -68.97 -38.85 79.63 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.952 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.18 -35.68 76.54 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.512 1.506 . . . . 0.0 111.361 172.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.61 -22.3 65.36 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.291 1.036 . . . . 0.0 112.582 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.87 -47.92 73.29 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.904 0.775 . . . . 0.0 111.391 167.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -36.76 76.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.123 0.874 . . . . 0.0 110.619 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 55.7 mt -74.55 -21.92 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.024 0.829 . . . . 0.0 112.277 177.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.2 m -79.18 -41.66 27.87 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.431 -1.418 . . . . 0.0 111.85 171.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.19 -25.16 29.74 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -137.99 63.95 39.55 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 125.475 1.51 . . . . 0.0 111.189 -175.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -64.07 -12.1 30.67 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.76 2.973 . . . . 0.0 118.567 -165.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -122.08 3.98 9.86 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.037 0.935 . . . . 0.0 112.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.0 123.34 82.15 Favored Pre-proline 0 CA--C 1.544 0.742 0 O-C-N 120.391 -1.443 . . . . 0.0 110.329 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -63.43 -11.34 25.34 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.364 2.043 . . . . 0.0 114.461 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -53.61 -36.2 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.034 0.834 . . . . 0.0 112.42 167.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.9 -50.86 16.86 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 121.485 -0.76 . . . . 0.0 112.351 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -61.65 -40.96 96.76 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.022 0.929 . . . . 0.0 112.587 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.6 p -70.24 -21.64 62.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.091 -1.006 . . . . 0.0 113.615 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.74 -46.27 19.29 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.684 0.794 . . . . 0.0 111.412 170.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.28 -41.35 84.15 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.969 0.907 . . . . 0.0 112.568 173.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.82 -32.0 70.24 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -68.93 -44.56 72.82 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.627 -0.67 . . . . 0.0 111.127 172.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.18 82.49 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.757 0.823 . . . . 0.0 112.818 177.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.09 -47.0 81.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.364 0.666 . . . . 0.0 111.582 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.59 -29.48 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.487 1.04 . . . . 0.0 112.991 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.21 0.23 33.35 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.33 12.32 7.01 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.636 1.974 . . . . 0.0 113.687 171.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.39 15.79 79.31 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.494 1.357 . . . . 0.0 116.494 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -91.9 44.47 1.17 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.827 1.651 . . . . 0.0 112.452 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.0 -37.3 68.95 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.36 1.064 . . . . 0.0 113.03 -175.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 62.4 m -62.46 -30.06 70.98 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.88 1.272 . . . . 0.0 112.52 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -87.38 -29.32 21.6 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.001 0.52 . . . . 0.0 111.149 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.29 -41.4 73.4 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.306 1.042 . . . . 0.0 113.059 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.8 pt -60.64 -34.45 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.138 0.881 . . . . 0.0 112.029 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -68.43 -51.49 43.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.587 0.755 . . . . 0.0 111.373 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.88 -29.29 70.49 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -66.65 -43.59 84.2 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.044 -1.035 . . . . 0.0 111.998 174.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -67.99 -36.95 80.87 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.724 0.693 . . . . 0.0 111.563 175.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.62 -32.88 73.04 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.3 -0.875 . . . . 0.0 112.845 168.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.09 -23.33 66.43 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.493 -1.38 . . . . 0.0 114.402 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.47 -20.02 65.94 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.499 1.65 . . . . 0.0 112.944 171.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -65.92 -5.45 9.34 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.529 1.532 . . . . 0.0 114.58 169.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -122.37 50.25 1.5 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.913 2.085 . . . . 0.0 110.664 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -136.17 4.27 2.94 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -67.09 -29.98 69.9 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -164.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.2 p -113.1 166.27 11.58 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.115 1.366 . . . . 0.0 112.668 -169.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.01 -30.83 64.53 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.06 16.42 0.16 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -133.18 10.26 4.14 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.485 1.514 . . . . 0.0 113.577 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.4 m -63.77 -30.26 49.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 O-C-N 120.503 -1.373 . . . . 0.0 114.123 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.9 -37.23 24.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.734 0.697 . . . . 0.0 111.24 173.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -55.29 -43.98 73.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.336 1.055 . . . . 0.0 111.293 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 49.8 ttp85 -60.32 -40.12 89.45 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.082 0.953 . . . . 0.0 112.046 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -66.75 -46.54 75.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.04 0.936 . . . . 0.0 112.678 170.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -51.73 -57.52 9.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.171 0.896 . . . . 0.0 111.394 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -67.22 -28.24 67.91 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.825 1.193 . . . . 0.0 113.562 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -74.3 -45.89 44.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.848 1.204 . . . . 0.0 112.81 174.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -33.21 73.06 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.039 1.29 . . . . 0.0 111.646 176.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.9 mmt-85 -55.65 -36.96 67.61 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.42 1.009 . . . . 0.0 112.064 171.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 20.1 tp -70.01 -44.14 69.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.142 0.883 . . . . 0.0 111.92 178.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -63.96 -30.29 71.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.047 0.939 . . . . 0.0 112.983 172.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.89 -20.22 23.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.56 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.778 1.626 . . . . 0.0 110.327 168.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -69.56 -16.67 63.46 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 171.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.71 -52.22 7.39 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 125.627 1.584 . . . . 0.0 113.382 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.4 -36.41 66.02 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.598 1.559 . . . . 0.0 112.444 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.479 0.982 0 C-N-CA 123.353 0.661 . . . . 0.0 112.212 174.579 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -15.49 49.33 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -74.17 -52.19 13.24 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 157.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.08 -39.8 60.27 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.265 1.026 . . . . 0.0 112.5 -176.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -72.27 -28.34 63.05 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -81.79 -34.65 30.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.218 1.372 . . . . 0.0 112.708 173.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -75.94 -41.06 52.77 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.123 0.969 . . . . 0.0 111.222 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -59.82 -39.4 84.93 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.867 0.867 . . . . 0.0 111.275 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.18 -50.62 51.11 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-N 119.108 0.867 . . . . 0.0 112.477 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -66.24 -40.81 90.5 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.315 1.057 . . . . 0.0 111.601 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 t -57.52 -43.11 84.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.421 1.088 . . . . 0.0 112.668 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.7 mt -67.2 -35.61 79.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.92 1.288 . . . . 0.0 112.142 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -70.3 -28.13 64.94 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 172.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.86 -14.34 61.47 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.283 1.033 . . . . 0.0 112.79 171.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -98.63 -53.87 3.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.873 1.269 . . . . 0.0 112.793 176.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.65 14.95 0.99 Allowed Glycine 0 CA--C 1.537 1.46 0 N-CA-C 115.364 0.906 . . . . 0.0 115.364 -172.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.0 mt -101.61 58.01 0.85 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.285 1.834 . . . . 0.0 110.21 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.99 -36.82 85.24 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.8 1.24 . . . . 0.0 113.499 -168.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.63 -33.19 27.95 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.227 0.921 . . . . 0.0 111.279 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -63.49 -39.99 95.89 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.15 0.432 . . . . 0.0 110.558 167.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.55 -45.88 77.95 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.491 -0.755 . . . . 0.0 112.757 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.06 -35.43 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.199 173.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -61.12 -44.75 96.85 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.857 1.208 . . . . 0.0 112.166 172.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.0 m -60.14 -39.94 88.11 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.841 0.856 . . . . 0.0 112.674 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -75.0 -38.14 61.68 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 175.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -62.49 -32.21 73.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.264 0.938 . . . . 0.0 111.452 172.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -69.36 -26.73 64.82 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 174.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.49 -42.6 78.59 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.988 1.267 . . . . 0.0 110.552 166.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.6 mt -80.93 -21.39 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.022 1.329 . . . . 0.0 111.642 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.1 m -66.29 -44.38 83.67 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.241 -1.537 . . . . 0.0 110.735 168.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.77 -19.9 31.88 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.867 1.267 . . . . 0.0 114.355 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -141.45 68.6 26.05 Favored Pre-proline 0 CA--C 1.556 1.181 0 C-N-CA 125.49 1.516 . . . . 0.0 111.143 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -67.18 -22.01 47.55 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.866 2.378 . . . . 0.0 117.037 -167.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.2 tp60 -100.18 -27.12 13.68 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.616 1.166 . . . . 0.0 111.794 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -69.51 138.18 88.68 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 123.865 0.866 . . . . 0.0 112.872 -171.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.28 -20.83 62.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.909 2.406 . . . . 0.0 113.935 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -46.22 -59.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 125.244 1.418 . . . . 0.0 112.222 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.51 -34.86 85.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 118.95 -0.917 . . . . 0.0 113.432 -172.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -62.62 -42.4 99.57 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.897 1.349 . . . . 0.0 111.285 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.7 p -67.06 -25.44 66.25 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -85.19 -38.82 18.53 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.931 0.892 . . . . 0.0 112.056 172.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -63.32 -31.29 72.4 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.1 -1.625 . . . . 0.0 112.173 173.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.26 -38.61 84.04 Favored 'General case' 0 CA--C 1.548 0.904 0 O-C-N 121.007 -1.058 . . . . 0.0 113.364 169.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -64.12 -43.46 95.2 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.74 0.816 . . . . 0.0 111.17 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.96 79.43 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.334 0.654 . . . . 0.0 111.878 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.75 -38.93 92.49 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.503 -0.748 . . . . 0.0 112.751 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.4 pt -75.79 -25.86 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 CA-C-N 120.111 1.323 . . . . 0.0 113.831 174.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -19.96 39.11 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.913 1.285 . . . . 0.0 113.143 175.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 tt -80.41 -43.52 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.687 1.595 . . . . 0.0 109.854 165.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.79 32.36 4.47 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.242 0.925 . . . . 0.0 113.802 -175.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -101.71 57.42 0.83 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.761 1.624 . . . . 0.0 109.232 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -59.33 -35.05 73.11 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.494 -0.754 . . . . 0.0 111.917 -170.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 88.4 m -62.08 -29.91 70.64 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.114 0.966 . . . . 0.0 112.785 174.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -81.57 -34.54 31.01 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 111.453 171.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.36 98.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.24 -0.913 . . . . 0.0 112.881 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.9 pt -64.33 -30.44 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.299 0.639 . . . . 0.0 112.681 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -71.08 -51.21 26.52 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.475 0.71 . . . . 0.0 110.767 170.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.6 ttm -63.51 -34.04 76.9 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -175.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.3 m -69.76 -42.64 73.58 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.17 -0.956 . . . . 0.0 112.053 175.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.17 -37.16 80.68 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.011 0.823 . . . . 0.0 112.078 177.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.43 -39.92 92.53 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.332 1.053 . . . . 0.0 111.867 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.41 -23.92 77.49 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.229 -1.544 . . . . 0.0 114.233 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.2 mt -66.93 -25.75 66.51 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.959 1.379 . . . . 0.0 112.348 169.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.78 -48.34 82.06 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.142 0.883 . . . . 0.0 111.24 170.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -64.24 -28.1 69.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.255 1.022 . . . . 0.0 113.351 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.5 p -118.64 -1.4 11.15 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -158.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -78.68 49.79 0.92 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.579 1.152 . . . . 0.0 112.825 177.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 t -157.46 153.46 27.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.622 1.569 . . . . 0.0 112.025 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.06 -35.59 25.8 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -164.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.52 -2.82 47.67 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -133.62 12.26 4.08 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.957 1.703 . . . . 0.0 113.098 -173.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.49 -24.86 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.74 -37.22 59.53 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.427 1.012 . . . . 0.0 111.133 171.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mm -65.6 -33.86 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.284 1.033 . . . . 0.0 111.186 173.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -57.41 -44.5 84.65 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.909 1.284 . . . . 0.0 111.401 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 m -66.55 -34.5 78.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.923 0.889 . . . . 0.0 112.56 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -68.9 -0.6 5.75 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 170.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.98 -33.39 6.93 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 117.522 -1.228 . . . . 0.0 113.405 156.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -54.6 -54.64 38.69 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.238 1.835 . . . . 0.0 112.092 173.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -30.17 67.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 122.08 -0.388 . . . . 0.0 111.452 -172.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -64.83 -40.3 94.96 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.35 -0.844 . . . . 0.0 111.563 170.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.57 -30.75 68.61 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.968 0.907 . . . . 0.0 112.159 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -68.69 -47.45 66.41 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.006 0.523 . . . . 0.0 112.063 165.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.88 -16.09 62.67 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.095 -1.003 . . . . 0.0 113.694 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.46 93.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.437 1.471 . . . . 0.0 111.327 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.58 -27.47 65.14 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 121.47 0.652 . . . . 0.0 112.038 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.67 -47.15 42.61 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.349 1.452 . . . . 0.0 112.782 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.17 -32.68 44.3 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.02 1.728 . . . . 0.0 113.218 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.478 0.96 0 CA-C-N 118.953 0.797 . . . . 0.0 111.112 170.791 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -13.2 59.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 174.589 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -77.81 -48.33 16.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 120.96 -1.087 . . . . 0.0 108.636 163.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -46.74 65.04 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.256 1.022 . . . . 0.0 111.974 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -66.92 -25.96 66.62 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.5 ptpp? -86.95 -30.97 20.91 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.987 1.267 . . . . 0.0 113.589 174.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -76.92 -31.85 56.95 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.968 0.803 . . . . 0.0 111.185 173.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -57.66 -52.62 64.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.624 1.57 . . . . 0.0 110.776 159.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.13 -45.97 71.59 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.175 0.898 . . . . 0.0 113.746 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -52.09 66.47 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.936 1.294 . . . . 0.0 111.479 173.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.4 m -60.15 -47.88 84.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.9 0.88 . . . . 0.0 111.379 -178.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -55.71 -35.65 66.32 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.727 1.211 . . . . 0.0 112.044 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -66.48 -41.66 88.64 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 120.069 1.304 . . . . 0.0 113.997 173.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -42.19 99.37 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 119.262 0.937 . . . . 0.0 111.833 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -72.35 -25.16 61.43 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.85 12.88 15.08 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.263 1.411 . . . . 0.0 116.055 171.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.2 mt -97.81 61.8 1.59 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.93 2.092 . . . . 0.0 111.047 -174.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -59.26 -30.52 68.35 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.642 1.177 . . . . 0.0 113.986 -175.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -84.31 -32.24 24.44 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.015 -1.053 . . . . 0.0 111.463 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -65.61 -42.79 91.21 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.821 164.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.08 -48.49 70.8 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.479 -0.763 . . . . 0.0 112.405 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 49.6 t -60.34 -33.48 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.574 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -59.68 -43.69 93.9 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.026 1.285 . . . . 0.0 112.592 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.3 m -70.3 -34.03 72.24 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.721 -0.612 . . . . 0.0 112.313 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -72.89 -40.2 65.75 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.877 0.871 . . . . 0.0 112.901 172.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -58.76 -36.06 73.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.546 1.138 . . . . 0.0 111.263 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.33 -14.45 60.1 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.67 -39.98 95.68 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.13 1.332 . . . . 0.0 110.251 161.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.9 mt -75.56 -44.59 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 m -60.1 -33.47 72.15 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.771 1.169 . . . . 0.0 112.286 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.39 -22.09 44.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -144.55 61.12 8.28 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.085 1.354 . . . . 0.0 111.802 -170.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -64.99 -20.52 64.05 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.353 2.035 . . . . 0.0 117.164 -158.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -113.27 3.26 15.88 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.074 0.95 . . . . 0.0 112.237 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -82.01 127.12 73.11 Favored Pre-proline 0 CA--C 1.541 0.608 0 O-C-N 120.717 -1.239 . . . . 0.0 111.613 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.39 -14.79 44.38 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 122.347 2.031 . . . . 0.0 113.806 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.58 -36.98 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-N 119.739 1.154 . . . . 0.0 112.287 170.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.38 -50.16 28.22 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 121.099 -1.0 . . . . 0.0 111.717 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -66.73 -38.56 86.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.303 1.041 . . . . 0.0 112.967 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.7 p -69.58 -14.46 62.85 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 173.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -91.81 -41.4 10.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.276 1.031 . . . . 0.0 111.946 168.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.37 -36.77 83.3 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.793 -1.192 . . . . 0.0 112.396 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.76 -35.3 76.05 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.327 -0.858 . . . . 0.0 113.021 170.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.6 tpt -68.85 -41.87 77.88 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.828 0.851 . . . . 0.0 111.657 175.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -46.11 84.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.746 0.819 . . . . 0.0 111.286 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.6 mt -59.57 -35.82 75.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.66 0.784 . . . . 0.0 112.951 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.5 pt -84.07 -17.78 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.01 -14.92 53.05 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.674 1.19 . . . . 0.0 112.429 168.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.5 tt -94.3 -50.61 5.18 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.924 2.489 . . . . 0.0 111.579 175.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.88 15.95 2.51 Favored Glycine 0 CA--C 1.54 1.646 0 N-CA-C 116.4 1.32 . . . . 0.0 116.4 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -105.31 53.69 0.71 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.413 1.485 . . . . 0.0 110.002 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.87 -29.55 69.61 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.032 -1.042 . . . . 0.0 112.998 -173.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.5 m -60.74 -29.8 69.6 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.953 0.797 . . . . 0.0 111.912 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -76.36 -36.33 58.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.106 0.562 . . . . 0.0 111.445 172.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.32 -37.93 74.83 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.8 pt -65.08 -33.32 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.896 0.771 . . . . 0.0 111.973 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.0 tm0? -68.6 -45.8 71.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.45 0.7 . . . . 0.0 110.818 171.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.9 ttm -73.77 -31.2 63.18 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -173.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.9 m -66.76 -39.91 88.04 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.907 -1.121 . . . . 0.0 111.464 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -67.48 -37.66 83.23 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.442 -0.786 . . . . 0.0 112.008 173.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.32 -31.93 72.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.284 0.634 . . . . 0.0 111.989 171.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.93 -24.56 64.06 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 120.241 1.382 . . . . 0.0 114.391 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.4 mt -62.3 -22.16 65.82 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.648 1.724 . . . . 0.0 112.253 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.68 -2.44 2.45 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 169.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -120.81 40.59 3.5 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.052 1.741 . . . . 0.0 111.665 -175.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 34.3 p -135.9 7.44 3.21 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 116.857 2.169 . . . . 0.0 116.857 -164.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 95.3 p -83.38 19.05 1.62 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -172.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -142.81 144.62 32.63 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.609 1.964 . . . . 0.0 109.61 177.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.79 -9.79 31.65 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.031 0.932 . . . . 0.0 113.465 176.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -59.12 -23.69 62.34 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.399 1.08 . . . . 0.0 112.309 164.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -129.92 24.22 5.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.937 2.095 . . . . 0.0 112.675 -176.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.06 -34.46 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 O-C-N 119.958 -1.714 . . . . 0.0 111.996 173.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.0 79.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.521 -0.737 . . . . 0.0 111.44 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.1 mm -65.13 -37.11 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.43 1.092 . . . . 0.0 111.184 170.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -59.57 -40.21 86.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.702 0.801 . . . . 0.0 111.997 177.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.6 t -70.04 -46.49 64.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.218 1.007 . . . . 0.0 112.162 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -72.05 -3.95 25.94 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -175.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -101.58 -33.13 10.04 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.064 1.302 . . . . 0.0 113.705 158.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -67.75 -49.71 61.04 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 120.381 1.446 . . . . 0.0 112.723 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -34.17 77.31 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.878 1.217 . . . . 0.0 111.19 174.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -65.04 -31.65 72.99 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.86 -1.15 . . . . 0.0 112.116 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.9 tp -71.63 -37.96 70.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.299 1.04 . . . . 0.0 112.774 169.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.03 -36.92 83.05 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.757 -0.589 . . . . 0.0 111.438 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.56 -25.49 35.8 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.889 -1.132 . . . . 0.0 113.259 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.72 99.89 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.47 1.486 . . . . 0.0 111.408 167.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -64.63 -27.18 68.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.801 0.84 . . . . 0.0 112.211 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.52 -46.04 57.09 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 125.688 1.613 . . . . 0.0 113.605 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.64 -28.79 61.02 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.6 1.16 . . . . 0.0 113.094 -177.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.7 p . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 178.977 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 119.698 -0.191 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -63.7 -37.22 86.53 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.425 -0.797 . . . . 0.0 112.835 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -72.21 -17.76 61.9 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.18 -28.32 16.35 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.3 -36.23 68.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.471 1.032 . . . . 0.0 112.512 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -60.1 -33.67 72.43 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.072 0.851 . . . . 0.0 111.344 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.62 -34.02 62.7 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.678 0.791 . . . . 0.0 113.041 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -64.74 -42.83 94.88 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.316 -0.865 . . . . 0.0 111.435 168.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.87 -41.83 99.39 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 121.669 -0.644 . . . . 0.0 112.482 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -58.74 -38.43 78.39 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.784 -0.833 . . . . 0.0 112.544 172.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -68.83 -42.46 77.17 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.683 0.674 . . . . 0.0 111.901 175.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -56.76 -40.45 75.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.868 1.213 . . . . 0.0 112.438 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.428 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 35.4 m-85 -58.14 -39.07 77.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.857 0.753 . . . . 0.0 112.322 171.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.56 65.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -84.86 4.46 33.13 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.226 0.921 . . . . 0.0 113.157 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.75 4.57 90.01 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-O 119.142 -0.81 . . . . 0.0 114.151 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.8 mt -84.62 54.04 2.89 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.313 1.557 . . . . 0.0 111.622 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -57.35 -32.25 66.56 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.897 1.279 . . . . 0.0 113.306 -173.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -83.59 -23.95 31.71 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.336 1.426 . . . . 0.0 113.039 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -75.76 -36.8 59.75 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.277 0.944 . . . . 0.0 111.21 164.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.428 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -75.76 -38.1 58.66 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.428 HG13 ' CE2' ' A' ' 27' ' ' TYR . 33.0 t -64.88 -35.56 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 O-C-N 120.626 -1.296 . . . . 0.0 110.885 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -59.88 -33.36 71.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.032 0.833 . . . . 0.0 112.267 171.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.6 m -64.64 -36.19 83.46 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.465 173.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.428 ' CE2' HG13 ' A' ' 24' ' ' VAL 0.336 0.2 OUTLIER -66.11 -29.82 70.2 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.491 1.496 . . . . 0.0 114.249 -178.826 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.59 -36.12 80.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.317 0.962 . . . . 0.0 112.096 172.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -61.62 -34.15 75.15 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.763 0.711 . . . . 0.0 112.659 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.41 -37.08 85.88 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 121.711 -0.618 . . . . 0.0 110.873 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.7 mt -82.18 -35.81 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 110.444 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.8 m -63.37 -31.66 72.88 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.4 1.454 . . . . 0.0 112.628 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.13 -29.37 57.79 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 169.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -134.65 61.81 50.59 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 124.838 1.255 . . . . 0.0 112.286 -169.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -64.04 -25.4 66.27 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.601 2.201 . . . . 0.0 117.279 -160.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -120.06 23.34 11.05 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.538 1.135 . . . . 0.0 111.728 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -106.44 123.29 39.28 Favored Pre-proline 0 CA--C 1.544 0.734 0 O-C-N 121.182 -0.949 . . . . 0.0 112.824 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.97 -13.64 24.03 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.116 2.544 . . . . 0.0 115.983 174.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.16 -37.77 57.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 120.262 1.392 . . . . 0.0 112.663 166.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.17 -44.49 60.04 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.647 0.658 . . . . 0.0 111.573 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -65.32 -37.73 88.0 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.874 -0.78 . . . . 0.0 111.628 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 37.3 m -59.99 -37.55 80.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.455 1.102 . . . . 0.0 111.884 171.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -81.47 -24.99 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.84 -40.82 92.1 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.971 -1.081 . . . . 0.0 111.614 163.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.25 -38.95 93.15 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.107 0.867 . . . . 0.0 112.596 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.1 tpt -60.41 -43.11 97.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.635 1.174 . . . . 0.0 112.043 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.21 -44.05 95.46 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.561 1.073 . . . . 0.0 112.417 172.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.5 mt -61.39 -44.57 96.92 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.536 0.734 . . . . 0.0 112.419 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -70.27 -29.0 37.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 119.432 1.014 . . . . 0.0 112.716 175.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -10.76 59.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -7.06 23.41 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.798 2.039 . . . . 0.0 112.55 167.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.21 14.21 75.01 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.7 1.143 . . . . 0.0 115.767 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -90.15 51.16 1.98 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.389 1.476 . . . . 0.0 110.769 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -55.35 -37.4 67.44 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.086 1.354 . . . . 0.0 112.467 -173.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.4 m -65.03 -22.84 67.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.993 1.317 . . . . 0.0 113.546 177.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -81.23 -39.5 25.26 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 110.769 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -37.41 87.04 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.596 -0.69 . . . . 0.0 112.707 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.0 pt -63.07 -33.17 59.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 113.127 177.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -72.68 -47.9 43.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.626 0.648 . . . . 0.0 110.969 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 29.0 ttm -63.58 -31.88 73.18 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 82.9 m -69.18 -39.93 78.42 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.121 -0.987 . . . . 0.0 111.798 174.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -69.4 -36.26 76.58 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.449 -0.782 . . . . 0.0 111.256 174.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.75 -30.74 69.06 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.724 -1.235 . . . . 0.0 112.701 167.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.18 -31.69 54.38 Favored Glycine 0 N--CA 1.47 0.913 0 CA-C-N 120.612 1.551 . . . . 0.0 113.573 171.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.54 -28.92 70.27 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.34 1.57 . . . . 0.0 112.325 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -58.3 -16.04 12.65 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -88.65 2.8 52.55 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.223 1.409 . . . . 0.0 113.424 173.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -114.27 80.27 1.37 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -167.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.1 m -134.64 7.07 3.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.943 1.297 . . . . 0.0 114.151 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -143.02 161.13 38.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.389 1.475 . . . . 0.0 112.197 -173.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.0 -5.92 29.79 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -164.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.25 9.71 42.35 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 120.581 -1.324 . . . . 0.0 114.419 173.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -135.96 11.33 3.35 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.1 m -70.13 -35.57 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 120.183 -1.573 . . . . 0.0 114.236 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.47 -29.39 46.8 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.975 -1.078 . . . . 0.0 111.457 171.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.5 mm -58.33 -35.03 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 121.515 -0.741 . . . . 0.0 111.447 165.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttt-85 -57.39 -46.74 83.12 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.441 1.019 . . . . 0.0 110.715 173.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 75.3 m -64.69 -37.31 87.13 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.407 1.083 . . . . 0.0 113.591 171.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -57.18 -48.99 77.37 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.275 0.943 . . . . 0.0 110.842 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.93 -25.59 56.11 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 117.303 -1.332 . . . . 0.0 113.775 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -58.06 -53.8 54.16 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 120.855 1.662 . . . . 0.0 110.41 166.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -30.03 60.78 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -58.42 -37.42 75.33 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.812 1.187 . . . . 0.0 112.103 169.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.92 -39.99 69.08 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.827 0.739 . . . . 0.0 112.098 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -58.02 -39.88 79.45 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.548 -0.72 . . . . 0.0 112.167 169.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.2 -19.46 33.98 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 120.965 -1.084 . . . . 0.0 113.771 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.42 -37.54 77.49 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.488 1.495 . . . . 0.0 111.373 164.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -69.11 -29.4 67.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.951 0.9 . . . . 0.0 111.826 169.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -55.3 13.84 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 126.374 1.94 . . . . 0.0 112.107 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.65 -27.72 65.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.123 1.369 . . . . 0.0 113.637 -174.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 N--CA 1.482 1.172 0 CA-C-N 119.056 0.844 . . . . 0.0 112.61 172.79 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.218 0.532 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -40.91 91.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.358 1.063 . . . . 0.0 111.358 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.2 -25.44 67.04 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.172 1.389 . . . . 0.0 113.161 171.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.7 -47.62 18.7 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.129 0.972 . . . . 0.0 111.49 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.66 -31.7 68.72 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -58.58 -35.02 71.73 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.298 0.954 . . . . 0.0 112.991 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.56 -21.25 20.19 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.68 -42.12 98.5 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.561 171.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.84 -36.96 91.73 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-O 119.218 -0.768 . . . . 0.0 114.224 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -57.15 -46.34 82.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.857 1.329 . . . . 0.0 111.989 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -67.54 -43.42 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.153 0.981 . . . . 0.0 111.748 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.21 -42.95 87.32 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.443 -0.786 . . . . 0.0 111.736 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.07 -40.0 83.84 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.918 -1.114 . . . . 0.0 112.447 170.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -33.91 77.04 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.45 1.1 . . . . 0.0 113.659 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.48 -9.49 59.62 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 18.72 55.46 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.046 -1.033 . . . . 0.0 114.621 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 mt -93.28 55.0 2.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.178 2.191 . . . . 0.0 110.002 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 -61.5 -38.89 88.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -167.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.28 -38.47 65.89 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.145 0.884 . . . . 0.0 110.917 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -66.02 -34.86 79.04 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 122.974 0.509 . . . . 0.0 111.967 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.39 -53.15 53.04 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.952 0.501 . . . . 0.0 111.986 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.2 t -63.26 -32.34 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.665 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -53.82 -51.47 63.43 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.175 0.898 . . . . 0.0 111.416 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 99.7 m -57.89 -40.2 79.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.083 0.953 . . . . 0.0 112.204 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.415 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 76.8 m-85 -70.47 -41.25 73.0 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.717 0.689 . . . . 0.0 112.659 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -67.34 -25.52 66.04 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.896 0.771 . . . . 0.0 112.492 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -65.38 -32.0 73.4 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.342 -1.474 . . . . 0.0 111.767 169.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -68.03 -38.75 82.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.075 0.852 . . . . 0.0 110.919 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.9 mm -68.29 -37.23 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.697 0.799 . . . . 0.0 110.595 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.1 m -59.93 -32.49 70.83 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.951 1.3 . . . . 0.0 112.708 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.41 -16.85 20.99 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -138.36 51.56 3.91 Favored Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 123.958 0.903 . . . . 0.0 112.707 -166.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -61.62 -27.09 81.08 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.383 2.055 . . . . 0.0 116.803 -159.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -102.38 0.5 34.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -83.11 118.85 72.94 Favored Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.028 -1.045 . . . . 0.0 112.361 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -54.34 -25.42 39.1 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.079 2.519 . . . . 0.0 114.852 174.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -52.48 -44.61 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.058 0.943 . . . . 0.0 112.376 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -44.83 60.83 Favored Glycine 0 CA--C 1.528 0.876 0 O-C-N 121.56 -0.713 . . . . 0.0 112.359 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -60.78 -33.73 73.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.465 0.706 . . . . 0.0 111.859 173.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.0 t -68.43 -41.63 80.07 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.264 -0.897 . . . . 0.0 113.092 172.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -64.87 -35.37 80.92 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 118.676 0.671 . . . . 0.0 111.294 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -73.37 -31.65 64.05 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.785 -1.197 . . . . 0.0 112.767 175.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.28 93.93 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.868 -1.145 . . . . 0.0 112.224 168.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 43.4 tpp -59.0 -40.5 85.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.051 0.941 . . . . 0.0 111.609 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.89 -45.68 91.74 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.516 -0.74 . . . . 0.0 112.776 174.056 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.9 mt -66.14 -36.35 82.89 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.531 -0.731 . . . . 0.0 112.691 -176.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.6 pt -71.61 -28.8 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.737 1.153 . . . . 0.0 112.966 171.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.34 -20.85 36.49 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 tt -81.16 -32.82 33.49 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.286 1.434 . . . . 0.0 110.528 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.45 21.0 10.22 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.26 1.41 . . . . 0.0 114.842 175.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -96.11 57.86 1.79 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.875 1.338 . . . . 0.0 110.058 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -54.55 -37.86 65.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.854 1.262 . . . . 0.0 112.603 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.72 -23.28 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.245 1.018 . . . . 0.0 112.566 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -87.84 -31.72 19.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.826 0.85 . . . . 0.0 111.884 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -40.3 88.14 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.624 0.769 . . . . 0.0 112.162 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.454 HG22 HD12 ' A' ' 84' ' ' LEU . 34.1 pt -62.2 -38.96 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 118.828 0.74 . . . . 0.0 112.011 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.83 -44.69 92.45 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.688 0.795 . . . . 0.0 111.177 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.5 ttm -65.23 -31.35 72.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.784 0.72 . . . . 0.0 112.928 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.2 m -69.45 -42.82 74.41 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.994 -1.066 . . . . 0.0 111.817 174.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -62.11 -41.53 98.32 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.723 0.692 . . . . 0.0 111.947 172.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -34.95 77.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.453 1.101 . . . . 0.0 111.797 172.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.38 -30.33 56.91 Favored Glycine 0 CA--C 1.532 1.107 0 O-C-N 120.651 -1.28 . . . . 0.0 114.393 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.59 -30.02 68.38 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.58 1.69 . . . . 0.0 111.949 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -63.85 -16.7 61.96 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -92.57 34.71 1.05 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.164 1.385 . . . . 0.0 113.045 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.9 p -144.21 137.78 27.6 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 120.511 -1.368 . . . . 0.0 114.055 -166.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.7 t -163.73 -50.34 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 163.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -85.47 175.73 8.66 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.714 0.806 . . . . 0.0 112.895 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.01 -10.62 51.73 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -170.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -2.03 42.59 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.081 -1.012 . . . . 0.0 113.394 167.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -120.65 -9.46 9.36 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.285 1.434 . . . . 0.0 114.436 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -68.59 -31.21 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 O-C-N 119.845 -1.784 . . . . 0.0 113.535 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.02 -37.67 64.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.19 0.904 . . . . 0.0 111.649 165.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -57.08 -32.91 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.376 -0.828 . . . . 0.0 112.979 175.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.3 mtm180 -61.79 -44.74 96.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.191 0.996 . . . . 0.0 112.006 174.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.3 t -65.66 -38.78 90.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 118.747 0.703 . . . . 0.0 111.485 169.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -73.0 7.26 2.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.42 1.488 . . . . 0.0 114.367 176.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -114.83 -33.25 5.53 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.527 1.058 . . . . 0.0 112.629 153.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -68.13 -41.29 81.9 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 120.455 1.48 . . . . 0.0 114.116 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.59 78.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.434 -1.417 . . . . 0.0 111.191 173.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -60.93 -37.02 80.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.488 -0.758 . . . . 0.0 111.122 174.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.454 HD12 HG22 ' A' ' 58' ' ' ILE . 38.3 tp -70.21 -40.87 74.31 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.067 1.347 . . . . 0.0 112.441 174.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.99 -31.31 72.45 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.39 -0.819 . . . . 0.0 112.609 171.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -88.35 -22.84 23.6 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.25 95.86 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.596 1.544 . . . . 0.0 110.183 165.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -71.59 -31.91 67.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.477 1.111 . . . . 0.0 112.146 173.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.61 -47.18 63.47 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.26 1.409 . . . . 0.0 113.545 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.33 -26.29 60.06 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.261 1.424 . . . . 0.0 113.12 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.4 p . . . . . 0 N--CA 1.476 0.842 0 CA-C-N 119.022 0.828 . . . . 0.0 112.481 173.969 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.599 ' N ' HE21 ' A' ' 3' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.571 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -92.66 -0.12 57.34 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 175.741 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -97.12 -37.95 9.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.212 1.805 . . . . 0.0 111.582 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -39.5 93.8 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.898 0.772 . . . . 0.0 111.499 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.85 -24.09 62.46 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -172.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -76.45 -36.62 57.82 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.185 -0.947 . . . . 0.0 112.942 171.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -66.24 -36.07 82.07 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.556 0.743 . . . . 0.0 112.261 170.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -63.65 -50.46 69.2 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.236 1.414 . . . . 0.0 111.088 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.84 -40.18 80.05 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.606 -0.684 . . . . 0.0 113.731 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.49 -37.72 83.27 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 118.765 1.282 . . . . 0.0 111.983 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 t -65.06 -46.03 82.89 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.228 0.611 . . . . 0.0 112.113 171.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.9 mt -57.68 -38.9 75.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.257 1.023 . . . . 0.0 111.996 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 50' ' ' LYS . 1.9 m-85 -56.59 -41.36 76.85 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.797 -0.564 . . . . 0.0 112.39 170.12 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -19.43 64.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.534 1.134 . . . . 0.0 113.901 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -91.84 -5.59 53.13 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.587 1.085 . . . . 0.0 113.693 168.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 11.35 72.1 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.15 -0.969 . . . . 0.0 114.526 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.5 mt -83.67 51.12 1.94 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.779 1.631 . . . . 0.0 110.616 175.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -55.76 -36.0 66.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.943 1.697 . . . . 0.0 112.85 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -86.94 -33.69 19.6 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.377 -0.827 . . . . 0.0 112.202 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -62.64 -41.02 98.8 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 118.511 0.596 . . . . 0.0 111.431 164.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.39 80.67 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.46 -35.15 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.729 -0.607 . . . . 0.0 111.205 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -62.63 -39.01 92.48 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.403 1.001 . . . . 0.0 112.029 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -64.77 -44.85 88.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.876 0.871 . . . . 0.0 111.781 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -63.06 -38.4 91.03 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.654 -0.654 . . . . 0.0 112.079 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.11 -26.45 68.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.641 1.176 . . . . 0.0 112.368 171.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -72.45 -27.68 62.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.302 1.41 . . . . 0.0 112.969 172.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.42 -44.0 92.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.728 1.149 . . . . 0.0 110.473 170.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.0 mt -66.32 -44.28 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.916 1.286 . . . . 0.0 110.103 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -61.01 -30.14 70.12 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.24 1.016 . . . . 0.0 112.384 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.77 -28.28 30.46 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 173.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -140.71 65.69 25.54 Favored Pre-proline 0 CA--C 1.562 1.409 0 C-N-CA 126.382 1.873 . . . . 0.0 111.552 -168.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -68.35 -19.19 43.96 Favored 'Trans proline' 0 C--N 1.353 0.806 0 N-CA-C 118.179 2.338 . . . . 0.0 118.179 -161.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -102.73 -8.66 20.67 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.381 -0.824 . . . . 0.0 112.736 177.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -77.3 140.76 65.55 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 121.21 -0.931 . . . . 0.0 112.352 -174.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.33 -9.01 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.541 2.161 . . . . 0.0 113.871 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 p -61.74 -46.16 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.948 -1.095 . . . . 0.0 112.233 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.13 -36.1 64.13 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 120.918 -1.114 . . . . 0.0 113.168 175.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -58.3 -39.68 79.96 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.707 1.254 . . . . 0.0 111.492 169.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.5 m -62.02 -29.98 70.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.716 0.806 . . . . 0.0 112.207 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -87.86 -29.45 20.9 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -63.16 -39.78 95.65 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 121.174 1.807 . . . . 0.0 111.205 165.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -34.1 75.86 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.904 -1.123 . . . . 0.0 112.925 169.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 tpt -63.75 -40.18 96.1 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.604 0.762 . . . . 0.0 111.724 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.94 86.96 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.708 0.685 . . . . 0.0 111.869 171.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -56.56 -41.7 77.32 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.42 1.009 . . . . 0.0 112.294 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.7 pt -76.1 -21.05 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.408 ' HB3' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -95.42 -15.7 22.81 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.031 1.287 . . . . 0.0 114.108 178.334 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.95 -28.4 15.82 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.455 1.902 . . . . 0.0 111.294 169.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CZ ' ' A' ' 54' ' ' TYR . . . 104.0 27.12 6.39 Favored Glycine 0 CA--C 1.531 1.078 0 N-CA-C 115.755 1.062 . . . . 0.0 115.755 173.115 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.02 54.49 1.12 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.385 1.088 . . . . 0.0 109.927 170.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.415 ' CZ ' ' HA2' ' A' ' 52' ' ' GLY . 7.0 m-85 -58.94 -32.79 69.91 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.726 1.21 . . . . 0.0 113.408 -169.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.8 m -75.12 -22.0 58.51 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.458 -0.776 . . . . 0.0 112.099 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.5 mm-40 -74.47 -36.57 63.31 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.58 -1.325 . . . . 0.0 110.931 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.66 -41.96 91.89 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.649 -0.657 . . . . 0.0 112.537 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.7 pt -61.63 -36.96 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.561 0.619 . . . . 0.0 111.998 176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -66.39 -50.33 63.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.297 1.039 . . . . 0.0 110.804 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.9 ttm -63.8 -32.3 73.77 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.1 -42.41 72.74 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 120.867 -1.145 . . . . 0.0 112.093 175.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -71.73 -33.53 68.8 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.112 0.869 . . . . 0.0 111.79 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.89 -36.86 77.84 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.335 1.054 . . . . 0.0 112.418 164.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.26 -29.8 61.71 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 120.266 -1.521 . . . . 0.0 113.902 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.51 -21.8 62.86 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.558 1.679 . . . . 0.0 112.626 172.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -66.11 -9.18 28.81 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 170.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -109.23 27.75 9.21 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.762 2.025 . . . . 0.0 111.985 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 32.1 p -135.18 -0.78 2.69 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 -166.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 69.5 m -79.44 40.51 0.44 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.831 -1.168 . . . . 0.0 113.014 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 t -150.9 145.57 25.72 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.9 -13.53 11.35 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.981 1.312 . . . . 0.0 114.169 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -70.07 -28.04 65.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.769 1.228 . . . . 0.0 112.416 168.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -134.84 21.4 3.54 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.988 1.715 . . . . 0.0 112.697 -169.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.63 -35.22 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 120.642 -1.286 . . . . 0.0 112.168 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.0 68.19 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.21 -0.931 . . . . 0.0 111.784 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.0 mm -67.68 -31.81 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.154 -0.966 . . . . 0.0 111.018 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -57.2 -40.87 78.3 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.248 -0.908 . . . . 0.0 111.441 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.9 m -76.96 -35.45 57.22 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.351 1.46 . . . . 0.0 113.603 174.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -52.36 -63.46 1.13 Allowed 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.779 1.172 . . . . 0.0 110.74 168.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -70.52 -26.63 63.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.073 0.851 . . . . 0.0 112.737 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.81 -35.31 64.87 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.04 1.291 . . . . 0.0 114.012 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.6 65.48 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.965 1.257 . . . . 0.0 111.343 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 57.3 mmt-85 -56.1 -42.93 77.56 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 119.575 1.08 . . . . 0.0 111.406 170.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.7 tp -67.54 -40.68 85.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.801 1.24 . . . . 0.0 112.469 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.63 -37.08 85.97 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.95 0.5 . . . . 0.0 112.31 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.2 -20.78 31.76 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.64 -47.81 83.14 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.281 1.4 . . . . 0.0 110.669 169.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.541 ' HA ' HG12 ' A' ' 91' ' ' VAL . 4.6 pt20 -76.02 -26.96 57.15 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 173.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -25.94 74.22 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 120.82 -1.175 . . . . 0.0 114.78 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -87.46 -33.7 18.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.92 1.288 . . . . 0.0 112.873 174.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.541 HG12 ' HA ' ' A' ' 88' ' ' GLN . 1.7 p . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -173.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 N--CA 1.467 0.408 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -7.66 56.9 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -87.57 -47.85 8.38 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.938 1.295 . . . . 0.0 111.078 170.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -27.73 67.9 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.773 -1.204 . . . . 0.0 112.608 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -28.15 63.7 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.101 1.319 . . . . 0.0 114.042 175.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -76.02 -30.27 58.43 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.687 -1.258 . . . . 0.0 111.369 171.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -71.29 -30.54 66.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 169.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.24 -48.6 81.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.188 0.995 . . . . 0.0 109.743 163.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.2 -38.91 57.39 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.896 0.76 . . . . 0.0 113.738 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -60.51 -47.86 84.32 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.432 1.116 . . . . 0.0 112.317 176.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.8 m -66.3 -36.22 82.4 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.355 0.662 . . . . 0.0 112.599 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -61.14 -44.69 96.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.258 -0.901 . . . . 0.0 111.055 175.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -58.89 -39.73 82.31 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.349 0.977 . . . . 0.0 112.656 169.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -27.93 65.88 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -84.75 -19.74 32.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.454 1.501 . . . . 0.0 113.07 170.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 9.69 38.22 Favored Glycine 0 N--CA 1.477 1.398 0 C-N-CA 125.256 1.408 . . . . 0.0 114.353 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.0 mt -87.41 55.74 3.65 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 127.734 2.414 . . . . 0.0 110.031 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -57.77 -40.2 79.23 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.429 1.092 . . . . 0.0 112.566 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -67.98 -39.34 83.31 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.144 0.884 . . . . 0.0 110.836 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.34 -33.14 71.12 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.255 1.022 . . . . 0.0 113.36 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.26 77.14 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.133 0.879 . . . . 0.0 112.377 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.86 -34.84 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.446 1.099 . . . . 0.0 111.402 174.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 -58.17 -33.85 69.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.286 0.948 . . . . 0.0 112.654 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 70.3 m -69.09 -46.15 68.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.803 0.729 . . . . 0.0 111.524 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -31.59 72.46 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.628 1.104 . . . . 0.0 112.067 174.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.51 -29.51 70.77 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.198 -0.939 . . . . 0.0 112.454 174.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -70.97 -30.45 66.72 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.396 0.998 . . . . 0.0 112.302 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.88 -54.01 47.9 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.849 0.75 . . . . 0.0 110.008 171.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 58.1 mt -73.94 -28.77 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 111.846 -171.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -71.06 -27.21 63.47 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 120.913 -1.117 . . . . 0.0 112.287 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.94 -25.75 27.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 168.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -143.77 78.09 14.49 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.729 1.611 . . . . 0.0 112.213 -166.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -67.1 -22.13 47.89 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.742 2.295 . . . . 0.0 115.575 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -133.98 -11.75 2.59 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -163.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -65.91 128.78 94.06 Favored Pre-proline 0 CA--C 1.547 0.857 0 O-C-N 120.604 -1.31 . . . . 0.0 108.644 164.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.62 -22.45 72.66 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.739 2.292 . . . . 0.0 114.063 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.18 -31.64 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.782 1.633 . . . . 0.0 114.23 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.65 -35.03 62.62 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.153 -0.967 . . . . 0.0 112.214 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -79.01 -37.3 39.5 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.193 0.997 . . . . 0.0 112.279 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.0 p -64.47 -30.41 71.44 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.5 -0.75 . . . . 0.0 112.835 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -79.43 -40.21 30.52 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 172.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -57.52 -40.49 78.88 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.151 0.887 . . . . 0.0 111.818 171.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.32 80.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 172.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -45.85 78.91 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.437 0.695 . . . . 0.0 111.935 172.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.78 -42.74 84.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.368 0.667 . . . . 0.0 111.512 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.99 -43.59 98.63 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.316 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.2 pt -72.47 -27.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 120.771 1.623 . . . . 0.0 113.585 175.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.5 -17.53 56.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.916 0.887 . . . . 0.0 113.164 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.26 -17.43 26.0 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.806 2.042 . . . . 0.0 112.02 166.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.89 29.97 21.91 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.023 1.297 . . . . 0.0 115.044 178.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.65 52.57 0.83 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.977 2.511 . . . . 0.0 109.628 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -58.92 -36.93 75.55 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 120.942 -1.099 . . . . 0.0 112.434 -170.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 m -62.05 -22.67 65.94 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.106 0.962 . . . . 0.0 113.405 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -81.29 -36.34 29.94 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.962 -1.086 . . . . 0.0 111.714 171.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.15 -38.5 78.83 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.8 pt -66.94 -30.84 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.706 0.802 . . . . 0.0 113.012 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -66.0 -49.72 66.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.292 0.637 . . . . 0.0 110.791 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 25.5 ttm -65.99 -31.01 71.67 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.8 m -71.74 -34.98 69.99 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.048 -1.033 . . . . 0.0 112.533 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -70.5 -33.34 71.1 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.086 -1.009 . . . . 0.0 112.346 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.75 -27.35 66.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.494 0.718 . . . . 0.0 112.189 168.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.01 -23.65 48.16 Favored Glycine 0 CA--C 1.538 1.525 0 O-C-N 120.302 -1.499 . . . . 0.0 114.778 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.84 -27.72 44.39 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.603 1.701 . . . . 0.0 112.511 166.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -64.33 -2.66 2.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 115.81 174.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -117.93 28.13 8.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.953 1.701 . . . . 0.0 112.121 -174.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.8 p -123.46 -9.77 7.98 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -161.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.5 p -76.28 32.7 0.12 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -147.42 144.78 28.9 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 127.856 2.462 . . . . 0.0 110.606 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.66 -21.53 64.49 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -61.72 -22.86 65.72 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.49 1.116 . . . . 0.0 113.128 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -129.37 22.03 5.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.678 1.591 . . . . 0.0 113.045 -171.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.28 -27.3 38.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 O-C-N 120.568 -1.332 . . . . 0.0 112.704 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.13 -29.4 34.79 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.842 -1.161 . . . . 0.0 112.014 172.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.0 mm -65.68 -32.63 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.932 1.293 . . . . 0.0 110.945 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -63.15 -37.97 89.31 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.179 -0.95 . . . . 0.0 112.975 177.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.7 m -67.66 -46.01 73.62 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.667 0.787 . . . . 0.0 112.286 166.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.69 -56.12 13.4 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.597 1.159 . . . . 0.0 111.704 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.4 -31.12 68.21 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.598 1.09 . . . . 0.0 113.462 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -71.1 -40.84 71.27 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.748 1.158 . . . . 0.0 112.433 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.28 67.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.38 0.991 . . . . 0.0 111.931 173.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.349 1.431 . . . . 0.0 112.217 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.5 tp -64.94 -37.86 89.06 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.776 0.83 . . . . 0.0 112.229 176.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.47 -46.89 58.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 15.8 tp -73.02 -19.52 61.18 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.619 -1.3 . . . . 0.0 112.596 -177.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.36 87.35 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 120.27 1.395 . . . . 0.0 112.489 168.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . 0.328 0.9 OUTLIER -78.79 -9.75 59.55 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 169.725 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -82.74 -43.76 7.58 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.23 1.395 . . . . 0.0 114.106 166.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.36 -28.99 65.55 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.075 1.75 . . . . 0.0 113.253 -177.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 172.773 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -15.74 57.2 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 175.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -77.01 -48.33 18.23 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.894 -1.128 . . . . 0.0 111.355 166.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -35.6 81.02 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.547 -1.346 . . . . 0.0 112.527 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.41 -21.92 62.79 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -84.55 -38.04 20.48 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.782 1.174 . . . . 0.0 112.253 171.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.86 -32.34 73.82 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 111.736 176.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -56.49 -42.55 78.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.576 1.15 . . . . 0.0 112.107 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.69 -43.09 96.53 Favored Glycine 0 CA--C 1.533 1.216 0 O-C-N 121.587 -0.696 . . . . 0.0 113.252 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -64.5 -37.77 88.68 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.604 -0.939 . . . . 0.0 112.049 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.3 t -66.76 -45.56 78.18 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.654 -0.654 . . . . 0.0 111.877 173.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.33 -36.67 73.75 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 112.575 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.8 -40.73 80.6 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 170.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -38.76 91.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.938 0.895 . . . . 0.0 112.78 175.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 4.24 10.84 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 173.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.16 4.38 90.24 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 121.069 -1.019 . . . . 0.0 114.274 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.7 mt -88.95 55.44 3.35 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.863 1.665 . . . . 0.0 110.674 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -57.05 -39.68 75.33 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.958 0.903 . . . . 0.0 111.837 -175.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.94 -38.21 69.86 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.53 -0.731 . . . . 0.0 111.553 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.53 -40.3 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.252 1.021 . . . . 0.0 111.763 171.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.49 84.11 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.351 -0.843 . . . . 0.0 112.034 175.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -59.37 -35.9 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.743 1.217 . . . . 0.0 111.063 172.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -63.22 -45.55 91.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.438 1.095 . . . . 0.0 111.577 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.15 -43.94 93.65 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.54 1.136 . . . . 0.0 112.011 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 24.7 m-85 -65.86 -35.21 80.03 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 0.0 112.396 174.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -67.94 -25.69 65.59 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.536 -0.728 . . . . 0.0 112.613 173.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.9 mm-40 -66.26 -34.7 78.6 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.283 1.401 . . . . 0.0 111.813 171.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.12 -48.11 83.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 118.689 0.677 . . . . 0.0 110.609 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.8 mt -72.03 -41.41 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.503 1.121 . . . . 0.0 110.212 -177.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.6 m -57.62 -37.93 74.1 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.768 0.827 . . . . 0.0 111.626 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.42 -29.25 47.03 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -136.08 62.16 44.15 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.625 1.57 . . . . 0.0 112.374 -168.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -64.42 -23.85 64.66 Favored 'Trans proline' 0 C--N 1.352 0.725 0 N-CA-C 117.516 2.083 . . . . 0.0 117.516 -161.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -104.01 4.85 34.93 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.267 1.027 . . . . 0.0 113.097 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -84.74 116.25 64.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 120.941 -1.1 . . . . 0.0 110.842 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.457 ' HA ' ' CD2' ' A' ' 41' ' ' TYR . 71.6 Cg_endo -64.19 -13.06 35.7 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.498 2.132 . . . . 0.0 114.223 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -52.24 -42.49 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 124.353 1.061 . . . . 0.0 112.228 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.01 -39.83 62.97 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.683 -0.509 . . . . 0.0 112.272 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 38' ' ' PRO . 2.7 m-30 -59.62 -38.99 82.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 117.576 0.688 . . . . 0.0 110.46 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.4 p -63.89 -35.93 82.27 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -79.43 -29.85 42.05 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.55 -0.718 . . . . 0.0 112.528 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -69.76 -33.17 72.05 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.417 1.008 . . . . 0.0 112.084 168.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.49 91.29 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.714 -1.241 . . . . 0.0 112.36 167.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.6 ttt -60.98 -37.81 83.74 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.641 -0.662 . . . . 0.0 111.865 170.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.417 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.58 -46.59 88.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.885 0.766 . . . . 0.0 111.761 173.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.1 mt -63.18 -37.4 87.07 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.554 -0.716 . . . . 0.0 112.678 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 26.6 pt -76.36 -7.64 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 172.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.37 -18.24 14.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.62 1.568 . . . . 0.0 113.207 176.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 tt -86.25 -34.64 20.35 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.563 1.945 . . . . 0.0 110.484 166.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.28 20.11 9.43 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.809 1.195 . . . . 0.0 114.961 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -96.35 53.61 1.33 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.015 1.726 . . . . 0.0 109.828 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -57.05 -34.58 68.39 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.778 1.231 . . . . 0.0 113.273 -169.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -66.63 -23.79 66.21 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.654 1.182 . . . . 0.0 112.299 176.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -85.63 -34.93 21.25 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.408 -0.807 . . . . 0.0 111.102 168.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.37 97.21 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.378 -0.826 . . . . 0.0 112.479 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.3 pt -59.78 -40.4 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.654 0.661 . . . . 0.0 111.799 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -64.73 -44.93 88.58 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.99 1.316 . . . . 0.0 111.238 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.2 ttm -68.24 -32.67 73.02 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.452 -0.78 . . . . 0.0 112.776 177.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.7 m -69.55 -42.62 74.34 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 120.802 -1.186 . . . . 0.0 111.853 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -60.72 -41.36 95.13 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.441 0.696 . . . . 0.0 111.357 172.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.95 -29.32 69.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 171.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.28 -28.25 45.29 Favored Glycine 0 N--CA 1.474 1.178 0 CA-C-N 120.768 1.622 . . . . 0.0 114.524 174.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.09 -20.76 65.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 119.887 1.844 . . . . 0.0 112.81 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -57.44 -11.98 2.29 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.51 1.524 . . . . 0.0 114.687 165.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -116.09 32.22 6.24 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 126.998 2.119 . . . . 0.0 112.242 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.6 p -136.99 8.48 2.99 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -167.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.2 m -78.62 2.89 17.85 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.4 t -144.27 156.08 44.12 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.891 -1.131 . . . . 0.0 113.177 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.12 -28.0 16.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.171 2.188 . . . . 0.0 116.734 -166.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -75.45 -0.0 18.57 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -132.27 16.91 4.52 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.974 1.71 . . . . 0.0 113.545 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.58 -27.73 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 119.534 -1.979 . . . . 0.0 113.338 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.85 74.2 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.655 -0.653 . . . . 0.0 111.193 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.29 -34.42 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.08 0.952 . . . . 0.0 111.033 174.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -52.51 -59.61 4.23 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.084 0.856 . . . . 0.0 109.901 171.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.7 m -61.64 -39.59 91.86 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.902 1.281 . . . . 0.0 113.115 176.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -79.44 4.4 15.64 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -110.65 -29.29 8.08 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 117.177 -1.392 . . . . 0.0 113.287 152.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -53.86 -57.72 9.91 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 121.315 1.871 . . . . 0.0 111.203 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -31.92 73.01 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.786 -0.571 . . . . 0.0 111.457 -172.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -62.98 -43.57 98.42 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.823 0.849 . . . . 0.0 111.152 174.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -66.92 -42.62 85.07 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.649 1.179 . . . . 0.0 111.194 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.3 -33.98 74.46 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.735 1.214 . . . . 0.0 113.095 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 18.8 mt -93.56 -12.29 29.87 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -46.21 78.41 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.932 1.696 . . . . 0.0 110.298 164.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -74.09 -16.24 61.03 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -76.06 -47.73 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.034 1.778 . . . . 0.0 113.579 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.19 -31.58 66.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.869 1.667 . . . . 0.0 112.816 -176.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.61 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 111.372 0.138 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -15.13 61.88 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.638 -1.289 . . . . 0.0 113.788 176.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.86 -46.67 14.91 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.927 0.891 . . . . 0.0 110.666 165.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -37.3 83.34 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.418 -1.426 . . . . 0.0 112.676 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -73.65 -24.26 59.98 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.918 0.887 . . . . 0.0 113.13 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -83.89 -31.81 25.5 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.15 0.886 . . . . 0.0 113.191 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.46 -45.38 69.19 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.928 0.785 . . . . 0.0 111.183 169.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -50.97 -48.15 61.21 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.841 1.256 . . . . 0.0 110.537 168.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.54 50.32 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 117.805 -1.553 . . . . 0.0 114.792 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -90.23 -41.91 11.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 121.061 2.431 . . . . 0.0 111.575 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.4 t -57.43 -36.83 71.88 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.549 -0.719 . . . . 0.0 112.338 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.2 mt -62.54 -39.64 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.96 -1.088 . . . . 0.0 112.207 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.99 -40.3 96.06 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.876 1.216 . . . . 0.0 112.585 169.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.71 -42.5 83.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.348 0.522 . . . . 0.0 112.223 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -74.7 -36.37 62.72 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.267 1.427 . . . . 0.0 113.278 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.36 10.4 8.0 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.382 1.467 . . . . 0.0 115.577 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -89.89 58.63 4.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.312 2.245 . . . . 0.0 109.64 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -60.07 -37.02 78.66 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.709 1.204 . . . . 0.0 113.595 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.5 mmt-85 -73.65 -42.37 61.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.73 0.695 . . . . 0.0 110.624 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -65.15 -30.04 70.93 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.3 14.09 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.49 0.716 . . . . 0.0 111.308 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.81 -35.31 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.989 1.315 . . . . 0.0 111.907 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -54.62 -45.79 73.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.724 0.809 . . . . 0.0 112.397 170.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.4 m -63.99 -38.92 92.85 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.167 0.894 . . . . 0.0 112.21 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -67.42 -35.83 80.05 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -65.11 -29.05 69.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 118.689 0.677 . . . . 0.0 111.908 174.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -72.3 -26.36 61.94 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.509 1.049 . . . . 0.0 112.764 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.0 mt -62.69 -49.31 75.6 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.204 0.601 . . . . 0.0 110.593 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.3 mt -80.93 -27.6 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.694 1.198 . . . . 0.0 111.195 -173.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.4 m -62.25 -27.89 69.32 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.383 -1.448 . . . . 0.0 112.194 168.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.78 -27.29 16.56 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 171.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -135.83 76.11 54.03 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.067 1.747 . . . . 0.0 110.426 -171.112 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -61.73 -25.0 78.27 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.938 3.092 . . . . 0.0 118.203 -166.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -116.46 -22.26 8.83 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.673 1.189 . . . . 0.0 112.502 -175.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.02 122.75 65.22 Favored Pre-proline 0 CA--C 1.545 0.777 0 O-C-N 121.657 -0.652 . . . . 0.0 112.57 -168.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.74 -20.4 51.13 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.112 2.541 . . . . 0.0 113.963 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.32 -32.65 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 119.114 0.87 . . . . 0.0 113.291 170.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.14 -40.89 15.05 Favored Glycine 0 C--N 1.34 0.778 0 O-C-N 121.409 -0.807 . . . . 0.0 111.846 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -70.93 -32.67 69.65 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -174.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.0 p -68.41 -41.12 80.88 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.722 1.601 . . . . 0.0 111.753 172.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -70.69 -36.44 73.3 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.832 0.853 . . . . 0.0 111.817 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -74.27 -29.5 61.69 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.565 -1.334 . . . . 0.0 112.115 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.04 -33.08 73.9 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.699 -1.251 . . . . 0.0 112.316 165.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -65.72 -40.58 92.37 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.333 -0.855 . . . . 0.0 111.189 171.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.96 86.79 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.586 -0.696 . . . . 0.0 112.516 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.63 -40.47 87.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.488 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 31.4 pt -76.38 -25.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 120.632 1.56 . . . . 0.0 113.452 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.17 -15.88 59.34 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 119.496 1.044 . . . . 0.0 113.268 172.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -92.28 -34.05 14.39 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.791 1.636 . . . . 0.0 111.734 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.16 25.1 5.18 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.557 2.027 . . . . 0.0 115.982 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -99.0 56.6 1.05 Allowed 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 118.941 1.371 . . . . 0.0 111.938 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -57.44 -30.45 65.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.028 1.331 . . . . 0.0 113.663 -173.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.4 m -72.42 -30.73 64.88 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.178 0.899 . . . . 0.0 112.491 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -78.46 -30.72 47.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.144 0.884 . . . . 0.0 111.281 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.67 -40.84 92.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.98 0.912 . . . . 0.0 112.516 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.9 pt -70.67 -25.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.6 tm0? -72.41 -44.15 62.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.677 0.672 . . . . 0.0 111.165 166.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.4 ttm -58.61 -31.83 68.45 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.78 0.718 . . . . 0.0 112.19 174.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 94.0 m -60.9 -46.89 88.84 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.512 -0.743 . . . . 0.0 112.572 171.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -68.87 -35.98 77.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.254 1.021 . . . . 0.0 112.209 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.52 -27.22 69.01 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.764 0.826 . . . . 0.0 112.454 168.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.4 -27.15 52.85 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.285 -1.51 . . . . 0.0 114.139 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.07 -12.49 55.79 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.096 1.448 . . . . 0.0 112.863 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -71.37 -5.55 33.47 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.22 1.408 . . . . 0.0 114.716 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.54 29.46 5.74 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.467 1.507 . . . . 0.0 113.659 -167.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 70.3 p -117.77 -5.14 11.11 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 -161.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.89 30.57 0.5 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -155.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.8 p -144.32 163.85 32.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.009 1.324 . . . . 0.0 111.828 -176.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.15 -28.12 69.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.099 0.96 . . . . 0.0 113.192 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.16 -19.69 64.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.006 0.922 . . . . 0.0 112.809 172.112 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -127.66 12.51 6.87 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -171.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 p -64.62 -32.92 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 120.837 -1.164 . . . . 0.0 113.225 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.3 -37.32 52.94 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.273 -0.892 . . . . 0.0 110.645 170.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.17 -37.78 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.905 0.882 . . . . 0.0 112.681 171.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ttp85 -59.16 -40.99 87.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.91 0.884 . . . . 0.0 111.281 176.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.1 m -70.62 -39.44 73.72 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.966 0.906 . . . . 0.0 112.84 167.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -61.96 -29.65 70.39 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.202 1.365 . . . . 0.0 112.715 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.7 -38.28 19.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.717 1.144 . . . . 0.0 113.498 169.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -66.89 -40.75 87.86 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 120.362 1.437 . . . . 0.0 113.706 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -36.81 73.67 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.498 0.59 . . . . 0.0 111.05 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -61.84 -36.14 80.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.881 0.872 . . . . 0.0 111.674 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.9 tt -67.4 -51.21 54.56 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.372 1.469 . . . . 0.0 110.6 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.07 -36.14 74.56 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.506 1.122 . . . . 0.0 112.562 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.48 -7.06 59.4 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 173.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.31 39.19 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 120.876 1.671 . . . . 0.0 109.179 164.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -63.51 -29.0 70.34 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.713 . . . . 0.0 111.388 169.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.41 -43.87 60.59 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 125.784 1.659 . . . . 0.0 113.707 172.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -76.11 -23.07 54.9 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 123.431 0.692 . . . . 0.0 112.839 167.994 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.293 0.0 OUTLIER -71.22 -26.9 63.13 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.525 -1.36 . . . . 0.0 111.782 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -70.77 -13.73 62.16 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.04 -35.61 10.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.488 1.04 . . . . 0.0 112.878 166.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -70.77 -36.73 73.2 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.264 0.938 . . . . 0.0 113.116 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.66 -21.54 66.44 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.909 -1.12 . . . . 0.0 112.804 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -90.52 -34.74 15.43 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.089 1.356 . . . . 0.0 112.481 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -56.08 -41.15 74.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.845 1.258 . . . . 0.0 111.811 174.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.14 -42.3 71.83 Favored Glycine 0 CA--C 1.54 1.608 0 O-C-N 121.442 -0.786 . . . . 0.0 113.546 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -68.57 -40.22 80.66 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.952 1.376 . . . . 0.0 111.289 175.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.6 m -58.74 -36.55 74.49 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.425 -0.797 . . . . 0.0 112.714 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.35 -34.04 76.48 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.88 -1.138 . . . . 0.0 111.809 173.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -70.49 -26.64 63.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -51.12 60.71 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.368 1.44 . . . . 0.0 110.343 166.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -66.55 -33.64 76.12 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -175.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.32 -0.4 8.83 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.956 1.142 . . . . 0.0 115.956 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.2 mt -89.54 53.16 2.52 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.233 2.213 . . . . 0.0 111.342 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -56.08 -36.89 68.63 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.892 1.677 . . . . 0.0 112.971 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -83.27 -28.52 29.08 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.03 -1.044 . . . . 0.0 112.982 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -73.43 -29.0 62.28 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 118.722 0.692 . . . . 0.0 112.118 166.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.21 69.05 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 172.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.6 t -60.24 -37.19 72.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 O-C-N 121.15 -0.969 . . . . 0.0 111.065 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -62.57 -45.75 91.48 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.66 -0.686 . . . . 0.0 112.237 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.5 t -55.19 -47.92 74.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.366 1.067 . . . . 0.0 111.481 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -68.67 -29.95 68.53 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -68.72 -23.47 64.36 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.224 -0.923 . . . . 0.0 112.78 168.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -69.63 -34.84 74.62 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.755 1.161 . . . . 0.0 111.242 172.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.47 -48.55 77.21 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.901 0.773 . . . . 0.0 109.915 174.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.8 mt -63.14 -37.95 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.952 0.501 . . . . 0.0 110.789 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.6 m -58.46 -39.5 80.09 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.47 -0.769 . . . . 0.0 112.027 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.25 -31.0 43.4 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.43 74.49 20.05 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 124.572 1.149 . . . . 0.0 112.859 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -63.35 -28.56 71.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.641 2.894 . . . . 0.0 117.436 -168.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -105.62 4.84 30.67 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.027 1.331 . . . . 0.0 112.957 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.51 120.55 73.18 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.342 -0.849 . . . . 0.0 110.103 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -61.93 -14.59 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 122.318 2.012 . . . . 0.0 114.226 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.4 p -47.14 -50.56 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.155 0.982 . . . . 0.0 111.416 167.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.11 -43.45 93.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 123.924 0.773 . . . . 0.0 112.5 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -63.53 -40.83 98.05 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.356 0.662 . . . . 0.0 112.169 173.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.0 p -67.43 -35.29 78.95 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.34 -0.85 . . . . 0.0 112.761 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -72.25 -38.51 68.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.144 0.978 . . . . 0.0 112.352 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -71.18 -32.26 68.65 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.411 1.005 . . . . 0.0 112.479 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.38 -42.09 96.35 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.114 -0.991 . . . . 0.0 112.322 168.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.0 -42.59 94.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.845 0.858 . . . . 0.0 111.511 171.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.97 90.78 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.706 0.802 . . . . 0.0 112.414 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 48.9 mt -64.51 -34.92 79.35 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.61 -0.681 . . . . 0.0 112.812 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.8 pt -73.62 -35.78 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.73 1.15 . . . . 0.0 112.892 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -12.83 61.36 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.44 1.096 . . . . 0.0 113.159 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.8 tt -93.44 -41.19 9.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.566 1.947 . . . . 0.0 111.528 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 110.63 21.85 6.63 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 124.772 1.177 . . . . 0.0 115.064 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -100.87 51.48 0.86 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.564 1.546 . . . . 0.0 109.67 171.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -51.02 -41.7 59.98 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.6 1.96 . . . . 0.0 112.624 -176.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.1 m -63.72 -25.95 68.43 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 113.158 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -81.19 -35.9 30.8 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.179 -0.951 . . . . 0.0 111.233 171.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -39.41 91.77 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.803 0.841 . . . . 0.0 112.195 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.3 pt -64.32 -34.76 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.762 0.71 . . . . 0.0 112.474 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.5 tm0? -64.47 -47.91 77.22 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.811 0.732 . . . . 0.0 110.551 171.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.5 ttm -63.18 -31.34 72.46 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 178.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.8 m -66.83 -46.18 75.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.971 -1.08 . . . . 0.0 112.362 173.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -72.41 -32.7 66.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.622 0.769 . . . . 0.0 111.867 -178.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -39.0 92.87 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.953 1.301 . . . . 0.0 112.382 164.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.18 -28.19 73.02 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 120.196 -1.565 . . . . 0.0 113.969 177.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.71 -23.1 67.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.454 1.127 . . . . 0.0 112.857 168.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -74.2 -0.18 15.99 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 169.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.22 20.71 15.98 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.597 1.559 . . . . 0.0 113.103 175.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -139.11 126.72 21.84 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.355 -1.466 . . . . 0.0 114.036 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -148.67 -36.02 0.19 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.073 1.749 . . . . 0.0 112.429 167.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.9 p -76.65 167.37 21.96 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.317 1.447 . . . . 0.0 113.622 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.86 -21.03 66.03 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.9 -1.125 . . . . 0.0 113.148 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.37 -28.45 66.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.401 1.08 . . . . 0.0 112.756 170.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -120.87 15.72 11.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.228 1.411 . . . . 0.0 112.369 -169.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.79 -37.24 61.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.247 -0.908 . . . . 0.0 112.259 -178.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.51 -36.41 63.2 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.688 -0.633 . . . . 0.0 110.623 172.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.8 mm -53.08 -39.98 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.397 1.079 . . . . 0.0 112.447 168.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -34.3 76.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.246 1.019 . . . . 0.0 112.257 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.9 m -80.21 -33.33 38.21 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.112 0.965 . . . . 0.0 113.489 166.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -71.94 -3.07 20.51 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.341 1.456 . . . . 0.0 114.382 176.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -96.84 -47.64 5.77 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.182 0.901 . . . . 0.0 112.205 153.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.13 -32.09 69.93 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -171.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.43 -37.99 74.49 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.177 1.353 . . . . 0.0 111.019 173.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.358 4.5 ptp180 -80.41 -12.86 59.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.84 -44.14 67.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.452 1.101 . . . . 0.0 111.168 157.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -35.98 78.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.981 1.312 . . . . 0.0 112.815 171.583 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.93 -23.83 28.66 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.89 1.276 . . . . 0.0 113.826 176.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.7 75.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.349 1.431 . . . . 0.0 109.715 168.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -59.45 -26.31 65.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.733 1.213 . . . . 0.0 112.01 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.38 -58.7 7.55 Favored Glycine 0 N--CA 1.467 0.732 0 C-N-CA 127.351 2.405 . . . . 0.0 113.622 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.71 -31.73 68.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.1 0.96 . . . . 0.0 112.471 -174.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 176.573 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -24.42 60.98 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.805 -1.185 . . . . 0.0 113.118 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.98 -24.31 30.66 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.998 0.919 . . . . 0.0 111.841 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.2 tttt -70.05 -51.2 33.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.081 1.752 . . . . 0.0 111.674 162.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -25.19 66.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -166.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.72 -40.0 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 172.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -71.19 -30.3 66.23 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.394 0.678 . . . . 0.0 111.655 175.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -68.1 -43.58 78.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.494 1.518 . . . . 0.0 111.05 170.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.36 -53.42 43.28 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.269 0.938 . . . . 0.0 112.679 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -56.37 -48.8 76.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.714 1.257 . . . . 0.0 111.659 174.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.7 t -55.92 -47.45 77.49 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.768 0.827 . . . . 0.0 113.153 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.4 mt -61.28 -28.56 69.27 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.278 -0.889 . . . . 0.0 112.815 -177.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -67.93 -37.49 81.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.282 0.946 . . . . 0.0 113.21 170.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -36.41 81.1 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 119.906 1.23 . . . . 0.0 112.648 172.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -74.5 -6.18 46.94 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 171.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.83 11.5 84.56 Favored Glycine 0 CA--C 1.537 1.462 0 O-C-N 120.37 -1.456 . . . . 0.0 114.992 -178.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 48.5 mt -87.32 54.33 3.11 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.844 2.058 . . . . 0.0 110.613 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -55.88 -36.19 67.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.359 1.063 . . . . 0.0 112.638 -170.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -80.56 -18.47 48.25 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.775 1.23 . . . . 0.0 113.01 -176.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.01 -36.41 17.04 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.063 0.545 . . . . 0.0 111.442 165.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.751 1.22 . . . . 0.0 112.733 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.51 -36.72 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.794 0.838 . . . . 0.0 110.389 172.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -64.85 -43.14 93.99 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.441 1.018 . . . . 0.0 112.872 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.67 -39.39 91.24 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.821 0.737 . . . . 0.0 112.263 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.464 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 32.8 m-85 -75.31 -35.53 61.23 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 175.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -62.38 -36.02 81.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.336 0.971 . . . . 0.0 111.414 171.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -74.71 -15.9 60.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 113.271 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.65 -47.37 84.68 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.304 0.956 . . . . 0.0 110.682 160.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.1 mt -81.79 -25.94 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.337 1.055 . . . . 0.0 112.053 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 m -62.9 -33.15 74.71 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.572 -1.33 . . . . 0.0 111.183 169.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.83 -37.07 18.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.607 1.163 . . . . 0.0 113.404 174.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -129.86 74.14 80.87 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 125.86 1.664 . . . . 0.0 110.603 -169.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -63.13 -19.44 68.8 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.723 2.949 . . . . 0.0 117.537 -167.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -124.3 -10.73 7.5 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.443 1.097 . . . . 0.0 113.107 -171.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -70.13 122.87 87.56 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 124.014 0.926 . . . . 0.0 111.258 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HB2' HG21 ' A' ' 76' ' ' ILE . 85.4 Cg_endo -67.95 -9.23 24.99 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.999 1.8 . . . . 0.0 113.999 179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -46.38 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.605 1.093 . . . . 0.0 110.989 163.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.52 -39.88 95.84 Favored Glycine 0 CA--C 1.527 0.802 0 O-C-N 121.266 -0.896 . . . . 0.0 112.03 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -65.36 -38.86 91.35 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 117.77 0.785 . . . . 0.0 112.128 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 m -62.44 -38.28 89.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.211 1.005 . . . . 0.0 112.041 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -75.14 -40.78 59.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.534 1.133 . . . . 0.0 112.224 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -65.12 -31.79 73.16 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 120.292 -1.505 . . . . 0.0 112.244 173.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.31 -36.53 83.98 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.259 -0.9 . . . . 0.0 112.561 169.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.4 tpp -63.58 -44.11 95.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.099 0.863 . . . . 0.0 111.276 171.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.464 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -57.09 -48.29 78.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.264 0.626 . . . . 0.0 112.08 175.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.59 -39.2 93.3 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.537 -0.727 . . . . 0.0 112.445 -177.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.52 -7.69 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 CA-C-N 120.07 1.305 . . . . 0.0 114.134 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.36 -20.1 14.72 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.053 1.341 . . . . 0.0 113.555 176.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.24 -9.7 49.73 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.411 2.284 . . . . 0.0 111.422 166.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.67 21.48 63.85 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.915 1.245 . . . . 0.0 114.866 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -92.59 51.2 1.7 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.561 1.944 . . . . 0.0 109.402 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -58.15 -37.17 74.14 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.081 -1.012 . . . . 0.0 112.445 -170.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.7 m -52.7 -31.81 39.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.899 1.28 . . . . 0.0 113.484 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -95.84 -27.09 15.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.353 1.461 . . . . 0.0 110.858 -177.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.21 -41.98 80.52 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.933 0.893 . . . . 0.0 112.078 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.5 pt -65.43 -35.01 74.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 118.999 0.818 . . . . 0.0 111.588 177.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -63.26 -45.54 91.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.013 0.925 . . . . 0.0 111.337 170.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 35.2 tpp -60.46 -43.76 96.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.955 0.798 . . . . 0.0 112.299 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.91 -46.61 84.04 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.128 -0.982 . . . . 0.0 112.246 177.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.75 -36.47 83.16 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.857 0.863 . . . . 0.0 112.181 174.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -38.48 84.73 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.176 0.99 . . . . 0.0 111.788 172.513 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.94 -34.17 65.44 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 120.269 -1.519 . . . . 0.0 113.598 178.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.78 -6.53 27.23 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 118.524 1.162 . . . . 0.0 113.401 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -76.48 -22.56 54.38 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 162.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -92.55 -7.31 47.57 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.862 1.265 . . . . 0.0 114.31 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.0 p -86.54 -1.13 57.37 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 -160.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 m -86.71 42.2 1.0 Allowed 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 120.206 1.366 . . . . 0.0 114.236 -169.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 p -138.62 159.65 41.57 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.198 1.399 . . . . 0.0 111.544 169.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.76 -6.97 17.99 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -87.18 -14.98 39.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.678 1.591 . . . . 0.0 112.259 171.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -126.36 14.51 7.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.455 1.502 . . . . 0.0 114.014 -173.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.19 -14.93 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 120.549 -1.344 . . . . 0.0 114.219 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.95 -39.19 15.95 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.914 -1.116 . . . . 0.0 111.267 164.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.409 HG21 ' HB2' ' A' ' 38' ' ' PRO . 47.6 mm -53.06 -36.48 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.132 0.973 . . . . 0.0 111.371 170.536 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.3 ttp180 -55.36 -39.5 70.14 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.831 1.252 . . . . 0.0 113.269 175.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.2 m -78.06 -37.9 45.65 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.036 1.335 . . . . 0.0 112.856 170.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.6 mttm -55.37 -51.72 65.88 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.943 1.247 . . . . 0.0 111.381 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.92 -31.19 64.47 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.092 1.315 . . . . 0.0 113.456 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -77.34 -30.72 54.09 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 120.971 1.714 . . . . 0.0 114.568 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -42.2 59.64 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.29 1.405 . . . . 0.0 110.655 166.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -62.16 -32.57 73.21 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.172 0.896 . . . . 0.0 111.688 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.5 tp -67.76 -44.28 77.87 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.756 1.222 . . . . 0.0 112.815 171.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -68.96 -32.46 72.06 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.282 -0.886 . . . . 0.0 113.352 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.6 tp -83.2 -22.12 33.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.46 -0.781 . . . . 0.0 112.678 174.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.92 92.39 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.522 1.51 . . . . 0.0 111.089 164.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -63.58 -30.04 71.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.033 0.933 . . . . 0.0 111.989 172.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.32 -49.57 44.68 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 125.697 1.617 . . . . 0.0 112.538 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.63 -37.55 70.86 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.738 1.215 . . . . 0.0 112.162 -177.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 N--CA 1.479 1.011 0 O-C-N 121.42 -0.8 . . . . 0.0 111.655 174.628 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -35.07 78.6 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.546 1.138 . . . . 0.0 112.332 170.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.257 0.2 OUTLIER -90.35 -14.43 33.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.92 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -27.97 32.94 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.667 1.187 . . . . 0.0 112.495 164.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -62.83 -50.68 70.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.958 1.303 . . . . 0.0 113.072 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -59.54 -30.48 68.63 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -49.59 49.5 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.727 -0.608 . . . . 0.0 110.912 171.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -58.72 -37.11 75.44 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.764 0.826 . . . . 0.0 111.56 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.89 -15.01 54.77 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.885 1.231 . . . . 0.0 115.176 174.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -94.84 -45.82 7.14 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.63 1.715 . . . . 0.0 110.754 168.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.3 m -53.41 -44.61 68.86 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.62 0.768 . . . . 0.0 112.755 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 mt -58.91 -38.11 78.18 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.246 1.018 . . . . 0.0 112.825 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -61.5 -38.16 86.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.283 -0.886 . . . . 0.0 112.05 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -71.17 -10.32 59.56 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -102.48 -0.79 31.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.018 1.327 . . . . 0.0 113.868 165.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.22 5.34 82.95 Favored Glycine 0 CA--C 1.536 1.365 0 O-C-N 121.116 -0.99 . . . . 0.0 115.001 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 98.3 mt -83.73 52.74 2.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.746 1.618 . . . . 0.0 110.952 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -56.87 -40.43 76.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.926 1.29 . . . . 0.0 111.924 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -72.96 -39.25 66.34 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.728 -0.653 . . . . 0.0 111.608 -178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -70.26 -32.65 70.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.445 1.02 . . . . 0.0 111.373 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.95 -44.3 89.87 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.015 -1.053 . . . . 0.0 112.183 173.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.97 -42.16 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.656 0.783 . . . . 0.0 110.924 171.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -58.53 -45.55 88.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.05 0.841 . . . . 0.0 112.516 174.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.2 m -62.72 -41.84 99.36 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.538 1.135 . . . . 0.0 112.5 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -67.48 -36.35 80.95 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.462 -0.774 . . . . 0.0 112.244 172.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.37 -28.52 69.75 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.722 0.692 . . . . 0.0 112.576 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -68.99 -28.81 66.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.89 -1.131 . . . . 0.0 112.229 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -63.5 -48.09 79.02 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.772 0.715 . . . . 0.0 110.373 169.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.6 mt -72.11 -24.72 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 C-N-CA 124.845 1.258 . . . . 0.0 111.241 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 94.5 m -68.32 -31.28 70.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.754 1.222 . . . . 0.0 111.455 172.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -85.41 -32.84 22.14 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.985 0.811 . . . . 0.0 112.803 169.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -132.21 77.71 70.29 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.18 1.392 . . . . 0.0 112.672 -169.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -65.98 -18.32 56.91 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 121.87 1.713 . . . . 0.0 115.088 175.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -113.3 -26.72 8.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.042 1.337 . . . . 0.0 112.896 -170.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -70.46 127.44 92.06 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.193 1.361 . . . . 0.0 111.486 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -67.9 -7.63 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.725 2.284 . . . . 0.0 115.277 -176.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 p -55.48 -39.61 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.808 1.243 . . . . 0.0 111.687 171.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.9 -45.56 32.85 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.365 -0.834 . . . . 0.0 112.115 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -64.75 -40.38 95.21 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.744 -0.857 . . . . 0.0 112.388 177.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 72.1 p -69.89 -18.52 63.41 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -83.9 -40.42 18.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 112.078 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.51 -37.69 73.4 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.64 -1.287 . . . . 0.0 112.018 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.98 -29.6 70.94 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 171.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.45 -42.68 87.28 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.042 0.837 . . . . 0.0 111.059 173.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.8 -46.42 87.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.966 0.506 . . . . 0.0 111.602 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 99.3 mt -59.27 -42.31 90.9 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.873 -0.517 . . . . 0.0 112.367 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.6 pt -73.73 -29.46 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.131 0.878 . . . . 0.0 113.339 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.56 -14.16 57.18 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.962 1.256 . . . . 0.0 114.095 175.513 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.5 tt -87.95 -23.16 23.95 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.39 1.876 . . . . 0.0 111.497 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.75 21.67 33.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.44 1.019 . . . . 0.0 114.463 -177.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -100.58 53.19 0.87 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.039 1.4 . . . . 0.0 110.734 173.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -52.36 -37.92 57.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.774 1.63 . . . . 0.0 112.378 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m -68.59 -15.44 63.53 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.042 1.737 . . . . 0.0 113.376 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -90.53 -33.66 15.84 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.37 -0.831 . . . . 0.0 111.588 165.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.6 -35.15 79.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 113.13 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 pt -62.74 -36.39 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.229 0.922 . . . . 0.0 112.985 177.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -67.06 -41.98 85.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.211 0.605 . . . . 0.0 111.605 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 ttm -76.38 -29.52 57.17 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.79 -39.34 73.2 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.019 -1.051 . . . . 0.0 111.207 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -59.79 -44.03 94.14 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.107 0.867 . . . . 0.0 111.536 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.43 -35.29 71.88 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 175.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.41 -27.18 52.73 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-N 120.265 1.393 . . . . 0.0 114.415 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -59.7 -32.74 70.8 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.266 2.033 . . . . 0.0 112.171 172.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -60.9 -17.61 51.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -85.51 -1.22 56.85 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.595 1.158 . . . . 0.0 112.942 175.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.7 p -106.0 22.06 16.27 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -162.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m -66.18 -32.79 74.44 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 p -104.8 166.65 10.24 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -174.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.87 -23.29 67.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.62 -22.83 64.2 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.828 -1.17 . . . . 0.0 112.656 174.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -124.17 17.46 9.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.21 1.804 . . . . 0.0 112.273 -169.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.09 -27.5 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.567 -1.333 . . . . 0.0 112.919 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.97 63.81 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.284 -0.885 . . . . 0.0 111.038 171.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.8 mm -58.83 -30.72 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.165 0.986 . . . . 0.0 111.261 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -64.94 -38.26 90.39 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.939 -1.1 . . . . 0.0 113.013 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.5 t -68.37 -43.29 77.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.302 1.441 . . . . 0.0 111.529 167.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.3 tppt? -54.21 -53.44 53.53 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.94 0.896 . . . . 0.0 111.814 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -74.23 -31.1 62.46 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 120.098 1.317 . . . . 0.0 114.011 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -75.28 -36.03 61.24 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.743 1.611 . . . . 0.0 113.433 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 -38.58 82.24 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.805 1.639 . . . . 0.0 110.828 172.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -56.06 -37.44 69.28 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 119.494 1.043 . . . . 0.0 111.627 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.8 tp -72.78 -42.83 63.53 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.263 1.025 . . . . 0.0 112.904 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -67.38 -23.66 65.61 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 175.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -97.77 -20.16 17.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.035 1.334 . . . . 0.0 114.211 174.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.27 -49.42 77.92 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.61 1.55 . . . . 0.0 109.498 163.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -64.44 -26.97 68.68 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.427 1.091 . . . . 0.0 112.484 171.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -80.81 -33.94 28.91 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.45 1.024 . . . . 0.0 115.406 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -93.88 -26.01 17.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.014 1.326 . . . . 0.0 112.926 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.479 0.983 0 CA-C-N 119.259 0.936 . . . . 0.0 111.75 170.52 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.59 -17.9 55.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.596 -1.315 . . . . 0.0 113.18 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -74.16 -46.04 44.84 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.965 -1.084 . . . . 0.0 109.632 162.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -43.1 80.65 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.596 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.48 -24.38 61.17 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 120.223 1.374 . . . . 0.0 113.689 -178.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.264 10.9 ptpp? -77.85 -39.03 44.77 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 119.431 1.014 . . . . 0.0 112.71 169.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.14 -40.7 94.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.192 0.997 . . . . 0.0 112.277 170.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -60.85 -49.14 78.69 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.056 1.742 . . . . 0.0 111.34 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -39.36 97.14 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 119.409 1.004 . . . . 0.0 113.134 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -61.03 -42.3 98.22 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.626 1.713 . . . . 0.0 111.948 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.3 m -61.1 -44.4 97.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.218 1.007 . . . . 0.0 111.415 174.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.7 -38.92 92.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.747 1.219 . . . . 0.0 112.093 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -59.66 -35.68 74.9 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.599 1.091 . . . . 0.0 112.435 170.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -19.88 64.96 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 174.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -100.79 3.7 42.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.313 1.045 . . . . 0.0 113.239 170.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.92 13.47 83.36 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 121.122 -0.986 . . . . 0.0 114.768 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.6 mt -87.71 56.32 3.86 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.202 1.801 . . . . 0.0 110.344 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -57.33 -39.56 76.12 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.486 1.114 . . . . 0.0 113.246 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.02 -39.35 75.85 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.95 0.795 . . . . 0.0 110.751 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -64.63 -43.6 93.17 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.407 0.683 . . . . 0.0 111.045 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.31 76.81 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.876 0.871 . . . . 0.0 112.714 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.62 -38.48 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.013 0.925 . . . . 0.0 110.442 173.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -61.11 -42.99 99.55 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.089 0.859 . . . . 0.0 112.865 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.3 m -63.39 -35.13 79.37 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.764 0.826 . . . . 0.0 112.668 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -80.73 -34.15 34.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.28 1.032 . . . . 0.0 112.478 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -62.92 -34.61 77.8 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.211 0.914 . . . . 0.0 110.963 168.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -71.31 -17.65 62.44 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.5 mt -59.41 -46.48 88.58 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.678 1.126 . . . . 0.0 110.605 161.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.4 mt -77.24 -30.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.383 1.073 . . . . 0.0 111.206 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.1 m -62.64 -41.49 99.07 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.662 -1.274 . . . . 0.0 111.113 174.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.92 -30.26 61.2 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 174.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -137.78 62.02 32.45 Favored Pre-proline 0 CA--C 1.556 1.209 0 C-N-CA 124.542 1.137 . . . . 0.0 113.391 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -61.89 -27.97 80.68 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.549 2.166 . . . . 0.0 116.429 -165.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -103.03 -1.43 29.26 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.186 0.995 . . . . 0.0 113.082 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -84.33 123.9 74.43 Favored Pre-proline 0 CA--C 1.543 0.695 0 O-C-N 120.878 -1.139 . . . . 0.0 112.179 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -55.24 -23.81 38.87 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.478 . . . . 0.0 114.928 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.72 -38.95 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.471 1.032 . . . . 0.0 112.844 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.08 -46.31 59.14 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 119.305 0.957 . . . . 0.0 111.521 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -62.91 -40.46 97.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.47 1.108 . . . . 0.0 112.189 173.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.2 m -58.96 -34.5 71.85 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.241 1.016 . . . . 0.0 112.626 174.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.46 -44.19 17.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.794 0.838 . . . . 0.0 111.337 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -60.08 -34.7 73.81 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 121.087 1.767 . . . . 0.0 112.196 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.14 -34.18 77.06 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 168.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.1 tpt -66.11 -44.29 84.75 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.272 1.029 . . . . 0.0 111.727 172.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.62 -45.9 88.23 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.087 0.955 . . . . 0.0 112.065 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.55 -36.02 77.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 118.789 -0.624 . . . . 0.0 112.666 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.1 pt -84.08 -17.24 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 173.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -21.45 46.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.066 1.346 . . . . 0.0 112.049 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -88.2 -63.15 1.34 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.327 1.851 . . . . 0.0 109.542 172.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.66 15.77 0.73 Allowed Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.276 1.271 . . . . 0.0 116.276 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.06 59.71 1.98 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.304 1.552 . . . . 0.0 109.648 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.1 -30.33 68.02 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.602 1.161 . . . . 0.0 113.509 -173.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.7 m -70.11 -20.46 63.19 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.968 0.804 . . . . 0.0 112.176 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -79.09 -34.3 43.69 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.35 -1.469 . . . . 0.0 112.149 166.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.87 -45.5 64.3 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.8 pt -59.56 -40.49 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 CA-C-N 119.411 1.005 . . . . 0.0 111.857 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.0 tm0? -63.35 -49.08 75.31 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.461 1.104 . . . . 0.0 110.924 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.9 ttm -66.11 -28.14 68.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -64.69 -47.26 79.02 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.137 -0.977 . . . . 0.0 111.415 171.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -67.91 -36.09 79.59 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.932 0.493 . . . . 0.0 111.867 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -35.43 74.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.544 0.738 . . . . 0.0 112.565 166.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -73.13 -28.56 66.14 Favored Glycine 0 N--CA 1.471 1.006 0 CA-C-N 120.17 1.35 . . . . 0.0 114.433 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.06 -26.05 68.66 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.371 1.585 . . . . 0.0 112.688 175.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -59.23 -16.96 24.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.103 1.361 . . . . 0.0 114.447 172.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -95.92 13.7 25.97 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.189 1.795 . . . . 0.0 113.967 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.258 16.4 p -122.51 -126.06 0.26 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.51 1.124 . . . . 0.0 113.171 -164.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 74.5 m 56.32 27.33 11.74 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 126.983 2.113 . . . . 0.0 116.475 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.6 t -149.38 154.21 38.57 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.534 -1.354 . . . . 0.0 113.04 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.89 66.94 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 -167.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -77.54 -6.73 54.65 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -124.22 6.97 8.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.512 1.525 . . . . 0.0 113.356 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -64.61 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.357 -1.464 . . . . 0.0 113.553 -173.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.93 -42.23 66.9 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.304 -0.873 . . . . 0.0 111.308 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.24 -41.0 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.05 0.94 . . . . 0.0 111.804 170.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 69.0 ttt-85 -58.18 -47.54 83.11 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.141 0.576 . . . . 0.0 109.868 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.3 m -65.17 -32.3 73.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 117.424 -1.274 . . . . 0.0 113.895 175.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -55.19 -48.33 73.95 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.674 1.579 . . . . 0.0 110.997 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -75.5 -29.02 59.39 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 31.2 mm100 -61.18 -50.48 72.96 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.556 1.525 . . . . 0.0 111.828 170.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -37.04 49.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.015 -0.517 . . . . 0.0 111.8 -174.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -59.48 -35.4 74.03 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.189 0.904 . . . . 0.0 111.588 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.03 -45.96 83.28 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.224 0.92 . . . . 0.0 112.102 172.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.53 -26.78 63.73 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.3 tt -89.61 -28.72 19.34 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.832 0.742 . . . . 0.0 112.622 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.22 -46.05 86.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.534 1.516 . . . . 0.0 111.727 173.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.57 -23.87 67.41 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.686 0.794 . . . . 0.0 112.814 171.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.85 -55.96 10.2 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.833 2.159 . . . . 0.0 114.29 170.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.62 -25.98 64.2 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.138 -1.213 . . . . 0.0 113.221 -176.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.483 1.222 0 O-C-N 121.212 -0.93 . . . . 0.0 113.219 168.677 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -38.87 10.08 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.705 1.138 . . . . 0.0 112.802 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -66.02 -16.12 63.63 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -33.15 22.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.901 0.881 . . . . 0.0 113.37 166.247 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -70.38 -36.56 74.18 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.324 -0.86 . . . . 0.0 112.189 -172.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -57.7 -41.04 80.89 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.438 1.095 . . . . 0.0 112.651 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -69.67 -34.52 74.1 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.043 0.537 . . . . 0.0 111.971 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -65.24 -34.4 78.27 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.259 1.024 . . . . 0.0 111.537 169.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.42 -49.19 58.19 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.294 1.426 . . . . 0.0 113.952 170.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -55.29 -34.63 64.29 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 118.632 1.216 . . . . 0.0 110.951 171.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.9 t -70.63 -40.62 72.99 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.46 1.104 . . . . 0.0 113.487 172.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.3 mt -57.34 -41.09 79.33 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.22 1.373 . . . . 0.0 111.314 174.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.527 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 83.8 m-85 -58.46 -39.98 81.41 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.132 0.878 . . . . 0.0 111.703 170.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -31.3 72.46 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.719 1.208 . . . . 0.0 114.079 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.71 -8.01 59.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.738 1.215 . . . . 0.0 113.761 171.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.495 ' HA2' ' CE1' ' A' ' 20' ' ' TYR . . . 91.16 6.2 66.91 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.995 -1.066 . . . . 0.0 114.437 -173.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 47.2 mt -82.86 44.51 0.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.49 1.516 . . . . 0.0 110.615 -177.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.495 ' CE1' ' HA2' ' A' ' 18' ' ' GLY . 5.0 m-85 -55.76 -34.86 65.6 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 113.032 -168.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -76.84 -35.52 57.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 120.503 1.502 . . . . 0.0 112.116 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.13 -24.48 62.28 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.206 0.603 . . . . 0.0 112.268 168.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -79.92 -35.47 37.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.958 0.903 . . . . 0.0 113.105 174.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.97 -40.36 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 O-C-N 121.015 -1.053 . . . . 0.0 110.402 168.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.01 -35.84 64.81 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.122 0.569 . . . . 0.0 112.026 169.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 t -67.81 -50.86 54.54 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.726 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -34.98 76.01 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.536 1.062 . . . . 0.0 111.58 178.1 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -62.21 -29.77 70.61 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.611 0.764 . . . . 0.0 112.679 174.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -65.93 -39.78 90.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.245 1.384 . . . . 0.0 111.714 171.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.5 mt -64.54 -37.63 88.22 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.855 -0.528 . . . . 0.0 110.511 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -80.33 -20.72 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 C-N-CA 125.458 1.503 . . . . 0.0 111.533 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.4 m -78.55 -44.44 24.21 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.156 -1.59 . . . . 0.0 111.588 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -91.57 -20.66 21.44 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -133.92 62.26 56.63 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 124.833 1.253 . . . . 0.0 112.169 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -57.45 -27.49 76.33 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.994 3.129 . . . . 0.0 118.699 -164.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -115.48 11.97 16.1 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.416 ' HB3' HG12 ' A' ' 39' ' ' VAL . 3.9 m120 -76.01 134.73 71.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 O-C-N 121.57 -0.706 . . . . 0.0 110.479 170.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.479 ' HB2' HG21 ' A' ' 76' ' ' ILE . 43.8 Cg_endo -55.54 -25.56 50.19 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.638 2.892 . . . . 0.0 113.932 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.416 HG12 ' HB3' ' A' ' 37' ' ' ASN . 6.0 p -55.01 -44.71 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 C-N-CA 125.339 1.456 . . . . 0.0 113.687 -175.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.04 -36.61 91.04 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -69.24 -36.68 77.44 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.122 0.969 . . . . 0.0 111.673 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.7 t -64.42 -42.91 95.78 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.361 -0.837 . . . . 0.0 112.278 172.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -75.43 -24.27 57.04 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -72.78 -37.43 67.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.212 1.005 . . . . 0.0 112.095 168.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.96 89.34 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.069 -1.019 . . . . 0.0 111.829 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.507 ' SD ' ' HE2' ' A' ' 50' ' ' LYS . 33.3 tpp -62.28 -45.53 92.84 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 112.135 171.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.26 -43.4 78.68 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.498 -0.751 . . . . 0.0 112.317 173.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.82 -41.03 92.32 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.699 0.8 . . . . 0.0 112.683 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 43.0 pt -68.85 -35.67 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.407 1.458 . . . . 0.0 112.287 172.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.507 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.2 OUTLIER -74.05 4.73 5.08 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 173.501 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.9 mt -122.19 3.55 9.82 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 128.26 2.624 . . . . 0.0 113.425 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.1 14.23 77.46 Favored Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.57 47.19 1.06 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.239 1.816 . . . . 0.0 111.86 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -60.05 -34.77 73.87 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.987 -1.071 . . . . 0.0 112.845 -171.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.32 -25.55 68.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.627 1.171 . . . . 0.0 112.532 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -81.29 -41.18 22.53 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.437 0.562 . . . . 0.0 111.054 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.76 88.54 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -175.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.2 pt -64.73 -35.15 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.779 0.718 . . . . 0.0 112.498 174.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -72.22 -44.23 63.24 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.782 0.833 . . . . 0.0 111.046 173.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.4 ttm -62.52 -30.02 70.99 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.885 0.874 . . . . 0.0 112.75 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 91.1 m -65.85 -39.14 90.48 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.99 -1.069 . . . . 0.0 112.113 171.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -70.67 -39.87 73.3 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.858 0.863 . . . . 0.0 112.077 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -35.59 77.36 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.361 0.664 . . . . 0.0 111.529 166.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.22 -31.21 78.48 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 120.539 -1.351 . . . . 0.0 113.279 175.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 98.2 mt -63.56 -29.18 70.47 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.032 1.416 . . . . 0.0 112.808 173.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -66.39 -8.03 23.03 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 170.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -102.68 11.59 37.48 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.036 1.735 . . . . 0.0 112.606 168.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.8 p -126.97 19.28 7.1 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.568 1.547 . . . . 0.0 113.932 -178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 m -81.8 3.83 24.44 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.897 1.279 . . . . 0.0 113.725 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -143.26 150.56 39.44 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 111.328 -166.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.2 -26.1 37.11 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.945 2.202 . . . . 0.0 116.945 -161.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -74.61 -4.81 39.34 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.736 1.153 . . . . 0.0 113.97 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -135.51 11.78 3.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.787 1.235 . . . . 0.0 113.908 -168.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.01 -9.36 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 O-C-N 120.322 -1.486 . . . . 0.0 114.94 -175.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.93 24.52 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.39 0.996 . . . . 0.0 110.459 158.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.479 HG21 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm -62.28 -27.89 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 O-C-N 120.866 -1.146 . . . . 0.0 112.041 174.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -48.35 -38.88 20.32 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.727 1.211 . . . . 0.0 112.438 168.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.7 m -79.36 -35.34 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.225 1.01 . . . . 0.0 113.465 170.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . 0.272 20.9 ttpt -73.69 9.66 1.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 170.464 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.89 -32.05 7.43 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.723 -1.236 . . . . 0.0 112.855 152.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -81.89 -31.39 31.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.51 -36.15 82.99 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 121.07 1.759 . . . . 0.0 110.191 163.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -63.55 -35.59 80.98 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.521 1.128 . . . . 0.0 111.446 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 21.3 tp -64.18 -45.04 90.11 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.014 1.325 . . . . 0.0 112.576 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -63.57 -32.53 74.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.058 -1.026 . . . . 0.0 113.062 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.9 -29.07 32.54 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.516 1.527 . . . . 0.0 112.499 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.02 -44.82 75.63 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.536 -1.352 . . . . 0.0 111.182 168.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -57.7 -27.34 62.84 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.793 0.837 . . . . 0.0 111.657 165.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.27 -61.8 6.26 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 128.885 3.136 . . . . 0.0 113.234 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.14 -31.28 68.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.866 1.266 . . . . 0.0 113.268 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 N--CA 1.482 1.128 0 CA-C-N 118.462 0.574 . . . . 0.0 111.742 170.363 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.37 -39.31 59.33 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.308 9.7 pt-20 -75.75 -10.0 59.06 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.33 0.968 . . . . 0.0 112.941 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -75.13 -57.53 3.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.254 1.422 . . . . 0.0 111.656 156.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -65.07 -34.93 79.59 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -167.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -65.18 -19.87 66.18 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -105.69 -21.36 13.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.616 1.566 . . . . 0.0 113.178 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -55.45 -34.73 64.75 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.158 1.345 . . . . 0.0 111.334 163.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -57.79 -28.96 61.02 Favored Glycine 0 CA--C 1.539 1.59 0 CA-C-O 119.016 -0.88 . . . . 0.0 114.724 172.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -60.76 -49.79 76.09 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.752 1.776 . . . . 0.0 111.87 174.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.5 t -68.92 -30.0 68.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.718 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 76.6 mt -64.31 -41.49 96.8 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.573 -1.329 . . . . 0.0 112.172 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -61.1 -34.94 75.75 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.376 -0.827 . . . . 0.0 112.643 168.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.2 -22.85 51.74 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -78.33 -26.31 46.8 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.436 1.094 . . . . 0.0 111.867 164.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.2 14.16 39.89 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.407 1.003 . . . . 0.0 113.951 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.43 58.62 4.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 127.228 2.211 . . . . 0.0 109.367 178.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -57.47 -36.45 71.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.782 0.833 . . . . 0.0 112.911 -172.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -79.86 -28.5 40.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.532 1.06 . . . . 0.0 111.553 -176.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -69.49 -38.11 77.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.664 0.785 . . . . 0.0 112.412 163.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -32.93 74.3 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 176.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.6 t -69.01 -38.97 79.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.138 0.975 . . . . 0.0 111.033 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -60.73 -33.77 73.41 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.141 -0.974 . . . . 0.0 113.002 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 p -74.01 -34.86 64.31 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 117.763 -1.113 . . . . 0.0 113.942 173.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.251 0.2 OUTLIER -67.09 -33.92 76.51 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.136 1.789 . . . . 0.0 111.693 169.898 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -62.53 -28.34 69.78 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.413 -0.804 . . . . 0.0 111.892 175.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -68.36 -33.8 74.93 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.709 -1.244 . . . . 0.0 112.539 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.63 -44.27 62.16 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.881 0.764 . . . . 0.0 109.19 177.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -70.85 -20.63 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.073 0.949 . . . . 0.0 112.103 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.5 m -68.63 -39.83 80.6 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.416 -1.428 . . . . 0.0 111.431 168.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -90.3 -28.22 18.91 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -177.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -132.29 60.26 49.64 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 126.151 1.78 . . . . 0.0 111.96 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -59.86 -26.56 82.66 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.195 2.596 . . . . 0.0 115.983 -170.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -106.97 4.44 27.17 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.492 1.517 . . . . 0.0 112.339 -170.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -93.13 130.32 36.4 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 120.813 -1.179 . . . . 0.0 112.969 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.41 -24.05 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.754 2.303 . . . . 0.0 114.107 174.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.49 -30.33 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 173.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.62 -42.35 55.01 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.357 -0.839 . . . . 0.0 111.121 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.45 -29.87 61.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 26.5 p -66.15 -42.9 88.42 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.105 1.321 . . . . 0.0 111.206 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -67.9 -44.51 76.81 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.475 0.71 . . . . 0.0 111.479 176.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -59.22 -41.91 89.76 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.851 0.86 . . . . 0.0 112.399 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.81 -37.29 86.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.379 0.991 . . . . 0.0 112.505 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.6 tpt -70.02 -39.58 75.71 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.626 0.648 . . . . 0.0 111.927 175.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.73 99.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.756 0.822 . . . . 0.0 111.735 172.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.84 -45.04 93.65 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.581 -0.699 . . . . 0.0 111.506 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 29.3 pt -68.44 -30.45 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.028 1.286 . . . . 0.0 112.87 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -11.37 59.85 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 175.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.6 tt -88.97 -29.08 19.79 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.07 1.748 . . . . 0.0 111.084 164.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 107.27 15.42 15.89 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.687 1.613 . . . . 0.0 114.695 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.93 48.71 1.06 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.312 2.245 . . . . 0.0 110.751 -178.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -59.85 -32.6 70.85 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.67 -1.269 . . . . 0.0 112.974 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 55.4 m -55.82 -31.35 62.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.162 1.785 . . . . 0.0 112.787 171.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -79.5 -39.08 32.9 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.669 0.788 . . . . 0.0 111.206 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.43 -39.61 89.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.869 0.868 . . . . 0.0 112.758 -176.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -65.2 -30.54 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.262 0.937 . . . . 0.0 112.912 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -77.35 -36.23 53.96 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.988 0.915 . . . . 0.0 111.698 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.9 ttm -66.65 -30.97 71.36 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 0.0 112.561 173.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 86.8 m -61.92 -43.16 99.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.321 -0.862 . . . . 0.0 111.927 171.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -65.94 -40.0 90.97 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.756 1.223 . . . . 0.0 112.916 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.26 -27.68 69.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.153 0.581 . . . . 0.0 112.312 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -22.17 61.25 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 120.606 -1.309 . . . . 0.0 114.717 174.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.4 mt -59.21 -27.35 65.65 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.847 1.824 . . . . 0.0 112.263 171.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -59.88 -10.76 4.33 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.397 1.879 . . . . 0.0 115.458 174.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -124.28 42.0 3.36 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.331 1.853 . . . . 0.0 112.712 -168.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.2 p -129.88 -12.68 4.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -164.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 60.4 m -81.64 49.46 1.33 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -168.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.2 t -164.07 153.35 13.96 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.904 1.681 . . . . 0.0 110.518 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.77 -11.08 32.73 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 120.993 -1.067 . . . . 0.0 113.139 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.49 -31.82 73.09 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.618 1.167 . . . . 0.0 111.932 165.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -130.87 16.87 5.19 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.238 1.415 . . . . 0.0 113.82 -169.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.6 p -69.98 -28.1 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 120.505 -1.372 . . . . 0.0 113.069 178.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.65 -34.99 22.93 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.36 0.664 . . . . 0.0 111.294 170.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 12.8 mm -51.38 -41.72 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 121.468 -0.77 . . . . 0.0 111.052 166.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -55.26 -47.33 75.62 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.847 0.749 . . . . 0.0 111.533 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.6 m -61.86 -42.29 98.87 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.975 1.31 . . . . 0.0 111.875 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -70.32 -4.02 20.13 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.577 1.551 . . . . 0.0 114.153 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -102.76 -31.62 10.23 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.8 1.182 . . . . 0.0 112.983 157.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -61.12 -53.59 55.14 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.837 1.653 . . . . 0.0 112.079 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -33.65 68.59 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.288 0.495 . . . . 0.0 111.105 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 tpp85 -66.3 -33.2 75.21 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.678 1.191 . . . . 0.0 111.684 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tt -66.82 -50.78 61.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.39 0.676 . . . . 0.0 110.445 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.03 -37.16 71.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 177.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.32 -26.35 35.7 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.925 1.29 . . . . 0.0 112.689 178.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.71 -42.62 90.89 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.743 1.61 . . . . 0.0 110.484 169.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.51 -29.54 70.57 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.453 0.701 . . . . 0.0 111.274 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.93 -60.33 8.61 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 127.756 2.598 . . . . 0.0 113.694 172.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.61 -27.24 68.51 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.419 1.887 . . . . 0.0 113.027 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 175.762 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 CA--C 1.545 0.767 0 N-CA-C 111.309 0.115 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -15.42 60.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 174.214 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -75.49 -50.89 14.33 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.756 -1.215 . . . . 0.0 111.429 164.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.276 0.0 OUTLIER -67.22 -29.4 69.04 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.853 1.206 . . . . 0.0 113.658 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.34 -39.14 71.51 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.023 1.283 . . . . 0.0 112.764 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -65.99 -20.44 66.19 Favored 'General case' 0 N--CA 1.485 1.289 0 O-C-N 120.886 -1.134 . . . . 0.0 113.111 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -95.54 -32.44 12.84 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.096 0.958 . . . . 0.0 112.568 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -59.07 -42.94 91.55 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.253 1.021 . . . . 0.0 111.045 170.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.6 -39.65 61.12 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-N 118.82 0.736 . . . . 0.0 113.753 173.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -70.1 -39.9 75.24 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.607 1.204 . . . . 0.0 111.178 177.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.3 t -60.29 -43.08 96.58 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 122.782 0.433 . . . . 0.0 111.426 172.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.8 mt -59.38 -40.66 87.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.222 -0.924 . . . . 0.0 111.652 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.141 1.337 . . . . 0.0 113.022 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.471 ' N ' ' HE2' ' A' ' 16' ' ' LYS . 1.1 mpmm? -68.11 -18.21 64.58 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 175.282 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -91.89 -7.14 50.08 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.912 1.285 . . . . 0.0 113.124 166.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.21 9.22 86.84 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 121.136 -0.977 . . . . 0.0 114.965 -175.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.0 mt -80.23 46.86 0.86 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.888 2.075 . . . . 0.0 111.893 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -50.7 -41.68 56.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.012 1.725 . . . . 0.0 113.431 -173.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -73.28 -27.4 61.54 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.288 0.949 . . . . 0.0 111.76 -175.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -81.88 -36.07 28.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.507 0.723 . . . . 0.0 111.065 170.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.24 71.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.624 1.17 . . . . 0.0 113.079 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.7 t -56.98 -40.86 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.771 1.228 . . . . 0.0 110.922 177.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.61 -42.07 98.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.538 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -61.26 -46.21 91.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 0.0 112.149 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -65.46 -33.23 75.45 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -69.62 -28.04 65.58 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.708 0.686 . . . . 0.0 112.362 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -66.42 -31.65 72.54 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.525 1.057 . . . . 0.0 112.096 173.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.3 mt -58.3 -37.7 75.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.423 1.011 . . . . 0.0 111.209 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -79.51 -22.92 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 122.711 0.405 . . . . 0.0 111.888 177.132 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -69.77 -41.46 75.14 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.798 -1.189 . . . . 0.0 111.083 169.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.21 -34.54 23.9 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -176.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -124.67 66.56 47.52 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 125.345 1.458 . . . . 0.0 112.697 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -58.39 -22.4 58.31 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.632 2.888 . . . . 0.0 119.01 -166.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -122.23 16.3 10.65 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.54 1.064 . . . . 0.0 112.653 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.7 m120 -89.5 124.29 64.65 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 111.215 174.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.24 -16.35 53.9 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.417 2.078 . . . . 0.0 113.949 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.48 HG12 ' HB3' ' A' ' 37' ' ' ASN . 4.4 p -51.58 -46.77 37.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.56 1.073 . . . . 0.0 111.892 171.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.26 -43.42 92.95 Favored Glycine 0 C--N 1.34 0.766 0 C-N-CA 123.522 0.582 . . . . 0.0 111.934 -176.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -58.89 -37.81 77.44 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 117.611 0.705 . . . . 0.0 112.431 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.4 p -65.35 -38.05 88.93 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.774 -1.204 . . . . 0.0 112.886 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -76.02 -37.11 58.79 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.83 0.852 . . . . 0.0 111.995 178.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.18 -33.46 70.01 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.9 -1.125 . . . . 0.0 112.505 175.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.43 83.49 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 120.922 -1.112 . . . . 0.0 111.717 166.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.4 tpt -63.35 -43.45 97.67 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.128 0.571 . . . . 0.0 111.812 173.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.16 -44.78 83.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.084 0.954 . . . . 0.0 112.1 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -64.18 -34.25 77.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.75 0.82 . . . . 0.0 112.848 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.3 pt -80.54 -17.14 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.735 1.152 . . . . 0.0 114.07 171.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.41 -13.13 53.03 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.466 1.506 . . . . 0.0 113.222 171.38 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 tt -101.82 -38.68 7.74 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.914 2.086 . . . . 0.0 112.077 173.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.19 22.44 5.88 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 124.726 1.155 . . . . 0.0 115.678 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -103.75 53.89 0.75 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.598 1.19 . . . . 0.0 109.094 169.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.51 -34.0 66.57 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 112.83 -173.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.9 m -64.82 -26.34 68.3 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.89 0.768 . . . . 0.0 112.144 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -75.62 -33.4 60.51 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.034 -1.041 . . . . 0.0 112.015 169.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.0 -40.59 71.76 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 112.75 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 25.4 pt -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.938 0.79 . . . . 0.0 112.068 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -62.38 -46.83 86.85 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.882 0.873 . . . . 0.0 110.985 170.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 50.3 ttm -62.2 -32.28 72.91 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.59 -0.693 . . . . 0.0 112.834 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.73 -49.53 62.13 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.051 -1.031 . . . . 0.0 112.031 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.43 -33.96 77.17 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 122.971 0.509 . . . . 0.0 111.811 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -65.31 -26.37 68.03 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.462 1.505 . . . . 0.0 113.349 169.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.44 -31.55 37.06 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 120.335 -1.478 . . . . 0.0 114.11 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.0 -32.01 70.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.611 1.705 . . . . 0.0 112.161 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -52.77 -22.63 5.53 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.48 1.512 . . . . 0.0 114.581 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -81.42 -12.83 58.81 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.439 1.495 . . . . 0.0 114.145 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -103.03 10.57 38.04 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 118.188 2.662 . . . . 0.0 118.188 -148.027 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -76.71 37.24 0.17 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.5 t -151.59 148.55 28.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.591 1.556 . . . . 0.0 111.278 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.31 -15.47 16.24 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 172.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -67.77 -26.83 66.31 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.174 0.897 . . . . 0.0 112.111 169.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -128.03 17.09 6.72 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.683 1.593 . . . . 0.0 113.665 -174.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.2 p -63.42 -31.17 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 120.093 -1.63 . . . . 0.0 112.595 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.02 -10.5 59.77 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.02 1.328 . . . . 0.0 113.756 174.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.3 mm -84.3 -35.85 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.829 1.251 . . . . 0.0 110.339 168.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -57.2 -39.35 75.24 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.694 1.198 . . . . 0.0 111.731 176.014 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.2 p -71.14 -47.5 57.49 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.082 0.953 . . . . 0.0 112.544 171.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 mttm -48.56 -57.26 6.45 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.403 1.002 . . . . 0.0 111.838 176.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.15 -30.07 67.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 117.979 -1.01 . . . . 0.0 112.976 -173.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -76.55 -38.06 55.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.651 1.569 . . . . 0.0 113.602 175.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.23 -39.2 65.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.703 1.138 . . . . 0.0 111.321 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.369 15.6 ptp180 -77.04 -11.24 59.78 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.448 1.476 . . . . 0.0 114.412 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.5 -41.44 55.32 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.248 1.019 . . . . 0.0 112.171 161.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.62 -39.19 83.45 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.104 -0.998 . . . . 0.0 111.343 167.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.47 -28.05 41.54 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.394 1.078 . . . . 0.0 113.572 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.72 89.07 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.751 1.16 . . . . 0.0 110.986 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.0 -26.96 68.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.839 0.856 . . . . 0.0 111.423 170.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.28 -49.65 55.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.728 2.109 . . . . 0.0 114.421 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.99 -27.14 61.62 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.611 -0.935 . . . . 0.0 112.562 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 N--CA 1.483 1.216 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -178.726 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 mp0 . . . . . 0 CA--C 1.546 0.805 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -34.52 26.13 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.614 1.097 . . . . 0.0 112.981 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -64.06 -23.51 67.35 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.502 1.521 . . . . 0.0 112.535 167.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.85 -46.34 25.07 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 125.962 1.705 . . . . 0.0 111.314 171.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -70.51 -27.25 64.04 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -62.53 -29.19 70.39 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 119.303 0.956 . . . . 0.0 112.967 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -85.83 -30.21 23.15 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 172.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.13 -43.88 91.99 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.983 -1.073 . . . . 0.0 111.091 171.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.22 91.44 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-O 119.231 -0.76 . . . . 0.0 114.079 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -55.21 -54.05 48.32 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.551 1.175 . . . . 0.0 110.358 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.6 t -57.86 -43.69 86.13 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.406 1.082 . . . . 0.0 112.166 177.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.33 -33.07 73.0 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.211 -0.931 . . . . 0.0 112.937 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -66.16 -40.04 90.24 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.844 1.202 . . . . 0.0 113.131 171.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -61.53 -40.43 94.63 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.708 -0.62 . . . . 0.0 112.151 173.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -18.85 64.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.417 1.265 . . . . 0.0 114.417 171.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.99 11.93 69.21 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 123.94 0.781 . . . . 0.0 114.864 -176.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.4 mt -89.03 57.52 4.15 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.234 1.814 . . . . 0.0 109.903 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -56.8 -39.24 73.77 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.939 1.295 . . . . 0.0 114.056 -170.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -83.33 -27.99 29.36 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.124 0.874 . . . . 0.0 111.582 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -70.74 -33.2 70.57 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.175 0.443 . . . . 0.0 111.925 164.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.31 -49.11 68.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.661 0.664 . . . . 0.0 111.803 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.3 t -59.05 -37.03 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.981 -1.009 . . . . 0.0 111.02 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -54.99 -42.14 72.09 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.859 1.209 . . . . 0.0 112.912 174.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.3 m -66.46 -37.06 84.3 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.091 0.859 . . . . 0.0 112.685 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 81.4 m-85 -75.06 -38.27 61.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 175.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -64.23 -35.72 81.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.26 0.624 . . . . 0.0 110.636 173.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -23.31 66.4 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 173.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.3 mt -60.61 -42.17 96.29 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.146 1.339 . . . . 0.0 109.46 168.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.1 mt -82.95 -28.6 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.4 1.48 . . . . 0.0 112.147 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -58.5 -32.87 69.2 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.662 -1.274 . . . . 0.0 111.512 168.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -89.61 -29.09 19.09 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 175.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -136.16 68.85 63.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 124.987 1.315 . . . . 0.0 110.774 -168.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -61.29 -36.8 77.53 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.291 1.994 . . . . 0.0 115.552 -163.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.37 6.8 38.94 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -174.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -105.24 130.49 23.01 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -158.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.49 -17.31 53.09 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.555 2.17 . . . . 0.0 113.414 168.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.78 2.44 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.613 1.565 . . . . 0.0 114.7 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -116.6 -36.97 1.02 Allowed Glycine 0 CA--C 1.531 1.09 0 O-C-N 121.5 -0.75 . . . . 0.0 112.679 155.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -60.29 -44.05 95.72 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.036 1.418 . . . . 0.0 112.881 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.4 p -67.8 -27.36 66.67 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.658 -0.651 . . . . 0.0 112.294 -177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -84.04 -42.24 16.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.495 . . . . 0.0 110.908 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -64.66 -32.12 73.64 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.245 -0.909 . . . . 0.0 112.335 172.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.49 -37.04 85.76 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.125 -0.984 . . . . 0.0 112.633 170.227 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 tpt -66.14 -38.74 88.87 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.856 0.862 . . . . 0.0 111.735 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.405 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.8 -42.35 93.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.409 0.684 . . . . 0.0 111.831 174.072 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.2 -36.68 84.93 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 118.58 -0.724 . . . . 0.0 112.68 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.3 pt -68.49 -33.84 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.312 1.415 . . . . 0.0 112.37 169.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.79 -12.33 60.02 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 -17.14 38.28 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.917 2.087 . . . . 0.0 111.039 163.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.8 22.09 56.34 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.856 1.217 . . . . 0.0 114.308 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -107.73 57.94 0.62 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.891 1.676 . . . . 0.0 110.123 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -56.21 -36.22 68.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.579 1.552 . . . . 0.0 112.497 -175.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.6 m -62.27 -26.73 68.56 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.387 0.994 . . . . 0.0 112.625 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -84.09 -28.74 27.33 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.511 -0.743 . . . . 0.0 111.93 172.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.16 -36.43 58.75 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.177 0.991 . . . . 0.0 113.298 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -68.17 -32.08 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.023 0.829 . . . . 0.0 111.996 175.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -61.55 -50.48 72.47 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.22 0.608 . . . . 0.0 110.049 166.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.5 ttm -69.09 -32.41 71.82 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -174.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -70.35 -39.59 74.58 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.827 -1.171 . . . . 0.0 112.034 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -73.07 -28.68 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.736 1.153 . . . . 0.0 113.394 171.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.73 -32.12 73.51 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.878 -1.139 . . . . 0.0 111.265 166.086 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.11 -22.7 73.28 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-O 117.87 -1.516 . . . . 0.0 114.514 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.6 mt -56.84 -29.71 63.08 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.288 2.044 . . . . 0.0 112.313 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -64.7 -1.13 1.71 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.193 1.797 . . . . 0.0 114.516 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -130.41 37.65 3.83 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.553 1.941 . . . . 0.0 111.482 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -129.73 -14.19 4.1 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 -167.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.6 m -80.12 22.4 0.52 Allowed 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -163.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 p -141.33 161.27 38.3 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 119.659 1.118 . . . . 0.0 111.97 -173.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.57 67.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -66.91 -18.22 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.237 1.015 . . . . 0.0 113.068 170.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -126.63 14.89 7.59 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.261 1.424 . . . . 0.0 113.88 -173.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.29 -29.99 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.975 -1.078 . . . . 0.0 113.055 177.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.76 -44.94 54.65 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.067 -1.021 . . . . 0.0 110.886 170.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.87 -35.84 53.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.275 1.43 . . . . 0.0 112.459 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 21.6 ttp-105 -58.83 -39.72 82.06 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.23 1.012 . . . . 0.0 112.219 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -77.7 -39.2 45.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.569 1.148 . . . . 0.0 112.234 172.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -68.59 -16.93 64.02 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -178.282 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -91.07 -32.09 16.01 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.053 1.297 . . . . 0.0 113.705 163.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -78.55 -42.3 29.68 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.402 1.455 . . . . 0.0 113.319 -175.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -34.86 78.74 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.969 1.259 . . . . 0.0 110.814 171.061 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -67.39 -36.93 82.28 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.681 1.593 . . . . 0.0 111.989 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.0 tp -67.96 -39.38 83.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.716 1.206 . . . . 0.0 112.051 170.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.5 -39.89 94.95 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.265 -0.897 . . . . 0.0 112.383 169.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.9 -29.51 62.1 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.981 1.264 . . . . 0.0 112.863 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.47 96.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.96 -1.088 . . . . 0.0 111.169 167.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.496 ' HA ' HG12 ' A' ' 91' ' ' VAL . 38.2 mt-30 -69.99 -19.89 63.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.216 1.006 . . . . 0.0 112.566 172.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -65.86 -62.8 4.46 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.819 2.152 . . . . 0.0 112.757 168.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.97 63.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -175.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 88' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.476 0.826 0 O-C-N 121.101 -0.999 . . . . 0.0 112.933 171.369 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 120.83 0.347 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.37 60.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.045 0.938 . . . . 0.0 113.298 176.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.22 -45.13 57.98 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 120.772 -1.205 . . . . 0.0 111.656 165.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -25.63 60.35 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.446 1.475 . . . . 0.0 113.855 178.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -75.58 -26.57 58.03 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.363 0.983 . . . . 0.0 113.274 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -69.33 -39.23 78.32 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.003 -1.061 . . . . 0.0 111.725 170.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.0 -39.06 93.27 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 169.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -59.44 -43.03 93.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.853 0.861 . . . . 0.0 111.479 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.23 -56.15 25.77 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 118.783 0.72 . . . . 0.0 112.183 173.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -54.89 -42.97 72.77 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.942 0.897 . . . . 0.0 111.852 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.8 t -68.88 -38.88 79.96 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.951 1.701 . . . . 0.0 113.43 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.4 mt -65.88 -35.36 80.43 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.779 -1.201 . . . . 0.0 111.322 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -63.3 -40.67 97.99 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.362 0.983 . . . . 0.0 112.269 169.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.06 -33.53 76.0 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.344 -0.847 . . . . 0.0 112.618 177.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.02 -30.82 55.96 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.456 1.102 . . . . 0.0 113.399 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.78 12.36 20.96 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.433 1.492 . . . . 0.0 115.12 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.77 53.79 2.94 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.058 1.743 . . . . 0.0 109.642 174.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -57.61 -36.32 71.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.57 1.148 . . . . 0.0 113.606 -168.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mmt-85 -75.84 -38.37 58.09 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.943 -1.098 . . . . 0.0 111.726 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.78 -31.91 71.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.694 0.397 . . . . 0.0 111.632 172.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.16 98.56 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.04 0.936 . . . . 0.0 112.65 171.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.72 -41.27 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.735 0.814 . . . . 0.0 111.299 173.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.1 m-70 -59.65 -38.46 81.48 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.226 0.921 . . . . 0.0 112.568 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 m -66.28 -26.46 67.34 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 117.72 -1.133 . . . . 0.0 113.573 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.93 -37.49 39.64 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 121.022 1.737 . . . . 0.0 112.261 168.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.87 -29.95 71.14 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.097 0.862 . . . . 0.0 112.094 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -66.64 -36.52 82.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.896 172.088 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.0 mt -63.8 -41.79 97.84 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.838 1.199 . . . . 0.0 111.217 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.21 -23.09 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.896 0.879 . . . . 0.0 111.019 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.4 m -78.17 -40.81 36.64 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.275 -0.89 . . . . 0.0 111.582 171.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.66 -31.5 24.14 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -129.69 66.39 77.14 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 126.169 1.787 . . . . 0.0 112.02 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -60.01 -26.69 83.11 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 123.297 2.664 . . . . 0.0 116.91 -170.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -106.56 5.86 29.51 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.456 1.503 . . . . 0.0 112.128 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.4 137.63 32.4 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 121.017 -1.052 . . . . 0.0 111.893 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HB2' HG21 ' A' ' 76' ' ' ILE . 57.9 Cg_endo -63.39 -22.78 71.67 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.176 1.917 . . . . 0.0 114.039 176.166 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.1 p -57.82 -42.09 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.971 1.308 . . . . 0.0 113.702 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.65 -40.39 46.37 Favored Glycine 0 N--CA 1.468 0.829 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -64.3 -37.34 87.14 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.239 1.02 . . . . 0.0 111.769 173.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.4 m -59.39 -30.22 68.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.961 0.904 . . . . 0.0 112.676 172.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.274 6.0 m120 -103.36 -16.07 15.74 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -176.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -65.96 -43.09 88.95 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.187 0.903 . . . . 0.0 110.648 155.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.35 89.26 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.143 -0.973 . . . . 0.0 112.661 170.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.2 tpt -62.61 -44.21 96.88 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.606 0.762 . . . . 0.0 112.324 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -46.03 89.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.178 0.991 . . . . 0.0 111.94 175.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.5 mt -59.45 -38.83 81.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.48 0.712 . . . . 0.0 112.349 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.4 pt -77.51 -27.98 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.758 1.163 . . . . 0.0 112.929 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -12.6 61.02 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 171.12 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 mt -118.16 -5.94 10.9 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.866 2.066 . . . . 0.0 114.957 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.32 45.37 8.13 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 119.264 0.938 . . . . 0.0 115.319 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -118.04 49.57 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.821 1.649 . . . . 0.0 110.094 169.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.27 -35.05 71.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.474 1.11 . . . . 0.0 112.959 -168.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.6 m -65.01 -31.26 72.4 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.625 1.17 . . . . 0.0 112.52 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -81.36 -31.31 33.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.087 0.555 . . . . 0.0 110.957 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.44 -44.95 85.71 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.712 -0.618 . . . . 0.0 111.621 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.9 pt -63.95 -29.69 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.997 0.817 . . . . 0.0 113.072 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -63.82 -49.62 72.13 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.49 0.716 . . . . 0.0 110.81 168.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 30.1 ttm -69.61 -26.2 64.32 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 71.0 m -60.25 -45.65 92.52 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.437 -0.789 . . . . 0.0 111.307 170.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -71.13 -40.57 71.31 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.461 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -34.1 71.31 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.3 -0.875 . . . . 0.0 111.756 171.162 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.81 -20.22 74.04 Favored Glycine 0 CA--C 1.533 1.204 0 O-C-N 120.66 -1.275 . . . . 0.0 115.025 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.18 -35.19 73.13 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.971 1.886 . . . . 0.0 111.17 166.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -72.55 -2.56 20.27 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -105.89 -5.12 19.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.953 1.301 . . . . 0.0 112.699 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 74.4 p -137.75 0.97 2.27 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -162.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.4 m -82.04 54.34 2.47 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.613 1.097 . . . . 0.0 111.918 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.6 t -157.94 151.37 23.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.764 1.626 . . . . 0.0 111.867 -175.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -47.96 -31.43 5.26 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.149 1.78 . . . . 0.0 115.312 -177.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -82.83 1.58 38.47 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -145.64 17.8 1.48 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 126.264 1.826 . . . . 0.0 113.625 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -64.34 -25.7 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.643 1.719 . . . . 0.0 115.643 -171.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.96 -20.13 20.27 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.546 1.538 . . . . 0.0 111.859 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.43 HG21 ' HB2' ' A' ' 38' ' ' PRO . 2.4 mm -70.43 -38.22 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 O-C-N 121.285 -0.884 . . . . 0.0 109.685 163.264 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -52.96 -43.44 66.38 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.071 0.948 . . . . 0.0 110.66 173.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -57.4 -39.98 77.27 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.613 1.565 . . . . 0.0 113.944 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.29 -47.02 82.55 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.307 1.412 . . . . 0.0 111.765 169.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.12 -32.99 72.77 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 120.037 1.29 . . . . 0.0 113.21 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -62.17 -50.31 72.36 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.374 1.443 . . . . 0.0 110.92 169.122 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . 0.255 0.0 OUTLIER -71.69 -31.13 66.43 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -173.94 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -52.37 -43.89 64.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.105 0.866 . . . . 0.0 110.87 165.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.38 -38.59 74.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.936 0.895 . . . . 0.0 111.945 -178.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.84 -34.18 77.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.832 1.253 . . . . 0.0 112.339 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -93.0 -11.93 31.93 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 174.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.35 -54.14 13.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.084 1.311 . . . . 0.0 110.166 165.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -70.07 -22.19 63.08 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 175.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.96 -60.67 5.86 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.316 2.388 . . . . 0.0 114.418 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.75 60.82 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.568 1.184 . . . . 0.0 113.386 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 171.098 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.2 tpp . . . . . 0 N--CA 1.484 1.271 0 CA-C-O 121.576 0.703 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.1 m -68.06 -22.29 64.95 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 119.417 -2.052 . . . . 0.0 113.68 -169.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -55.4 -37.88 68.17 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.402 -0.811 . . . . 0.0 112.414 175.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -10.92 60.09 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -88.83 -36.7 15.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.115 1.366 . . . . 0.0 111.92 172.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -80.19 -24.28 40.41 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.42 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.5 -30.2 62.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.371 0.987 . . . . 0.0 112.791 175.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -73.38 -33.03 64.82 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.952 -1.093 . . . . 0.0 112.971 171.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.15 -36.72 83.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.505 0.722 . . . . 0.0 112.614 169.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.48 -44.54 93.03 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.376 -0.827 . . . . 0.0 110.544 168.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.11 -50.53 58.83 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.556 0.598 . . . . 0.0 113.384 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -61.49 -40.71 95.54 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 118.432 1.116 . . . . 0.0 112.011 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -64.14 -36.94 85.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.388 1.075 . . . . 0.0 112.383 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.5 mt -69.8 -39.02 76.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.341 1.057 . . . . 0.0 112.114 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 51.1 m-85 -61.49 -28.51 69.35 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 118.932 0.787 . . . . 0.0 112.533 167.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.8 -7.34 54.2 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -110.98 -31.32 7.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.953 1.301 . . . . 0.0 112.859 172.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.8 9.15 14.48 Favored Glycine 0 N--CA 1.476 1.31 0 C-N-CA 124.216 0.912 . . . . 0.0 114.474 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.84 54.87 3.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.994 1.717 . . . . 0.0 110.293 176.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -57.23 -34.51 68.65 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.008 0.923 . . . . 0.0 113.26 -171.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.23 -32.76 56.06 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.311 1.414 . . . . 0.0 111.845 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.92 -32.97 65.68 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 118.668 0.667 . . . . 0.0 111.969 168.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -67.45 -41.03 85.37 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.905 -1.122 . . . . 0.0 112.298 173.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.4 t -62.02 -39.74 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.545 1.138 . . . . 0.0 110.89 168.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -56.91 -32.47 65.96 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.314 0.961 . . . . 0.0 112.369 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.7 m -71.71 -39.74 69.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.259 -0.877 . . . . 0.0 113.295 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -38.71 75.05 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.301 1.409 . . . . 0.0 111.081 172.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -61.13 -32.17 71.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.107 1.363 . . . . 0.0 111.855 177.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -60.99 -40.08 92.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.671 1.123 . . . . 0.0 112.072 171.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.22 -42.8 88.2 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.774 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.1 mt -76.18 -22.52 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.123 0.969 . . . . 0.0 111.188 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 55.6 m -67.96 -41.92 81.68 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.891 -1.756 . . . . 0.0 111.222 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.32 -20.9 26.13 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.83 65.22 37.76 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.655 1.582 . . . . 0.0 110.809 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -61.93 -22.95 75.31 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.581 2.854 . . . . 0.0 117.27 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -123.33 10.68 9.28 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.42 1.488 . . . . 0.0 111.27 -170.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -90.64 131.77 36.94 Favored Pre-proline 0 CA--C 1.544 0.737 0 O-C-N 120.574 -1.329 . . . . 0.0 111.292 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.75 -17.46 60.01 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.683 2.255 . . . . 0.0 114.065 177.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.7 p -53.55 -42.67 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 119.028 0.831 . . . . 0.0 111.926 170.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.55 -37.97 85.81 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.18 -0.95 . . . . 0.0 111.624 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -69.84 -35.24 74.6 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.556 0.742 . . . . 0.0 112.64 175.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.6 t -61.26 -36.77 80.92 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.073 -1.017 . . . . 0.0 112.469 170.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -77.97 -28.49 49.43 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.513 0.725 . . . . 0.0 112.57 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -68.17 -41.94 80.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.873 1.215 . . . . 0.0 111.65 166.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.07 81.44 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.119 -0.988 . . . . 0.0 112.404 173.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -61.53 -49.41 76.82 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.269 1.028 . . . . 0.0 111.457 169.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.57 82.35 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.258 0.623 . . . . 0.0 112.221 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.3 mt -62.08 -42.85 99.63 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.894 0.878 . . . . 0.0 112.598 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.14 -20.73 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 119.55 1.068 . . . . 0.0 113.123 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.24 -8.27 56.99 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.604 1.162 . . . . 0.0 114.061 172.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.4 7.79 21.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.68 1.992 . . . . 0.0 112.735 170.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.16 17.98 79.65 Favored Glycine 0 CA--C 1.535 1.343 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 174.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -104.28 52.83 0.75 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.848 1.659 . . . . 0.0 110.75 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.64 -29.89 64.94 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.101 1.36 . . . . 0.0 112.683 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 m -62.99 -27.67 69.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.679 0.792 . . . . 0.0 112.506 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -77.02 -40.86 44.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.176 0.898 . . . . 0.0 111.299 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.09 93.22 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.385 -0.822 . . . . 0.0 113.005 -175.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.7 pt -63.88 -30.66 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -78.24 -45.56 22.61 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.6 171.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.9 ttm -65.13 -28.87 69.72 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.162 -0.961 . . . . 0.0 113.083 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.9 m -66.42 -39.93 89.25 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.99 -1.069 . . . . 0.0 112.295 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -62.71 -45.73 91.37 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.036 0.835 . . . . 0.0 110.391 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.99 -37.06 68.61 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.87 -23.65 59.32 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.224 1.375 . . . . 0.0 115.066 177.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.74 -18.93 65.68 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.57 1.685 . . . . 0.0 112.416 171.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -72.14 5.01 3.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.443 1.497 . . . . 0.0 114.829 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -121.35 44.18 2.61 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.475 1.91 . . . . 0.0 111.037 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.0 p -132.13 -2.19 3.6 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -164.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 81.6 p -63.93 -15.85 60.1 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 -164.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 p -120.17 165.97 14.06 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 120.586 1.539 . . . . 0.0 113.7 -173.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.82 -0.86 1.64 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.1 1.36 . . . . 0.0 114.594 174.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -83.32 -17.63 41.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.344 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -129.98 15.09 5.78 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.492 1.517 . . . . 0.0 114.203 -166.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.54 -30.34 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 120.494 -1.379 . . . . 0.0 112.32 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.55 -38.81 81.11 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.176 -0.953 . . . . 0.0 112.086 171.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.2 mm -61.56 -37.93 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.593 1.157 . . . . 0.0 110.687 174.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.09 -44.37 96.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.607 1.163 . . . . 0.0 112.619 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 t -63.78 -48.54 76.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 111.892 167.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.3 ttpt -58.0 -44.43 87.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 112.939 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.05 -24.47 51.98 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.779 1.172 . . . . 0.0 113.794 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.96 -34.2 59.81 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.278 1.399 . . . . 0.0 113.459 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -35.37 58.59 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.116 0.871 . . . . 0.0 111.647 168.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -57.76 -40.58 80.1 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.039 1.29 . . . . 0.0 111.659 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -65.69 -41.76 92.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.933 0.893 . . . . 0.0 112.874 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.817 0.847 . . . . 0.0 111.017 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.21 -20.03 35.37 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.77 -50.88 65.07 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.925 1.239 . . . . 0.0 110.329 164.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.86 -28.25 69.36 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.927 0.891 . . . . 0.0 111.964 171.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.24 -55.68 17.47 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 127.535 2.493 . . . . 0.0 112.591 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.69 76.52 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.986 1.714 . . . . 0.0 112.56 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.3 p -82.97 -41.79 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 175.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -87.89 -20.38 50.48 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 116.046 1.179 . . . . 0.0 116.046 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.7 m -74.26 145.91 43.65 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.944 1.372 . . . . 0.0 111.906 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 35.4 m -129.66 -6.79 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.533 1.533 . . . . 0.0 113.181 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . 0.302 16.1 tm0? 64.09 -6.45 0.26 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 128.61 2.764 . . . . 0.0 116.844 176.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mt -82.79 116.2 62.71 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.19 0.996 . . . . 0.0 110.1 172.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -84.66 -15.59 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.679 2.92 . . . . 0.0 113.673 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 t 61.99 18.08 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 126.406 1.882 . . . . 0.0 114.763 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.9 m -150.22 155.9 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 127.832 2.453 . . . . 0.0 109.567 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 54.31 -157.0 0.2 Allowed 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 125.307 1.443 . . . . 0.0 114.002 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.4 m -139.63 20.94 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 125.283 1.433 . . . . 0.0 113.814 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.87 -41.27 91.83 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.27 1.428 . . . . 0.0 113.073 -170.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -130.35 -74.9 0.54 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.518 -0.739 . . . . 0.0 111.269 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 58.5 mt 61.38 158.51 0.11 Allowed Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 127.231 2.212 . . . . 0.0 115.246 -176.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -62.6 168.77 9.43 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.485 2.123 . . . . 0.0 111.542 152.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -68.12 138.15 55.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 112.491 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 73.14 -113.55 4.36 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -166.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 28.6 t80 61.36 -69.74 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.108 2.563 . . . . 0.0 115.491 -177.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -140.49 21.54 2.37 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -170.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -134.29 33.31 3.34 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 C--O 1.25 1.108 0 C-N-CA 126.576 1.95 . . . . 0.0 111.097 179.374 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.5 mpt? . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -109.7 149.31 29.93 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.912 0.885 . . . . 0.0 112.176 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -150.33 108.7 3.78 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.528 1.531 . . . . 0.0 108.891 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 74.7 t 65.84 132.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.274 1.83 . . . . 0.0 115.017 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 . . . . . 0 C--O 1.256 1.416 0 C-N-CA 126.46 1.904 . . . . 0.0 114.158 -166.024 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 111.362 0.134 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -59.53 -30.07 68.33 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -168.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -65.37 -30.02 70.8 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.5 1.5 . . . . 0.0 112.608 176.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.61 -30.88 66.29 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.103 -0.998 . . . . 0.0 112.527 177.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.45 -28.12 64.77 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.034 1.734 . . . . 0.0 112.48 165.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.34 -45.61 17.49 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.742 0.817 . . . . 0.0 112.9 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -66.28 -27.17 67.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.882 1.219 . . . . 0.0 112.858 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -64.01 -45.93 86.75 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.604 1.093 . . . . 0.0 111.571 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.77 -34.78 60.27 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 -39.8 71.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.958 1.254 . . . . 0.0 111.649 175.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.97 -35.26 91.77 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 120.925 -1.109 . . . . 0.0 112.714 170.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -62.23 -40.46 96.21 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.127 -1.219 . . . . 0.0 112.111 169.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.3 t -63.23 -35.85 81.69 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.513 -0.742 . . . . 0.0 112.151 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.4 mt -65.98 -36.93 84.65 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.606 -1.308 . . . . 0.0 112.482 172.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.73 -33.56 76.15 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.651 1.114 . . . . 0.0 112.228 167.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.9 -2.28 17.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.573 1.549 . . . . 0.0 114.598 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -113.28 -50.74 2.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.495 1.918 . . . . 0.0 112.35 175.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.3 0.23 3.41 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.863 1.22 . . . . 0.0 115.34 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -85.33 51.99 2.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.749 2.42 . . . . 0.0 111.319 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.88 -33.57 70.64 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.987 1.315 . . . . 0.0 113.15 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -68.7 -47.11 67.22 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.927 1.24 . . . . 0.0 110.351 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.41 -36.58 79.31 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.325 0.39 . . . . 0.0 111.41 176.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.16 77.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.318 0.647 . . . . 0.0 112.62 176.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.2 t -62.43 -37.28 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.674 0.79 . . . . 0.0 110.77 174.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -61.02 -39.2 88.85 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.037 0.835 . . . . 0.0 112.651 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -66.04 -40.96 91.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.44 0.696 . . . . 0.0 112.199 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -68.4 -37.31 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.609 -0.682 . . . . 0.0 112.485 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -63.56 -26.14 68.56 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -76.69 -26.89 55.24 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.746 1.157 . . . . 0.0 113.52 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -62.0 -31.2 71.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.096 0.862 . . . . 0.0 110.491 170.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.2 mt -79.75 -41.93 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 124.461 1.105 . . . . 0.0 111.652 173.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 52.3 m -52.51 -42.3 64.2 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.694 1.588 . . . . 0.0 112.057 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -24.59 53.88 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -140.42 57.43 8.68 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.179 1.392 . . . . 0.0 112.781 -169.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -64.31 -23.95 65.34 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.383 2.055 . . . . 0.0 115.731 -166.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -95.15 -14.07 24.48 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.535 1.134 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -88.12 128.16 54.68 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 119.141 0.882 . . . . 0.0 112.675 -172.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -60.88 -22.79 75.26 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.641 2.227 . . . . 0.0 114.05 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.7 -30.77 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.4 1.48 . . . . 0.0 113.607 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -35.58 55.53 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.36 -1.462 . . . . 0.0 112.136 174.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -79.72 -33.85 40.54 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.572 1.149 . . . . 0.0 112.489 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.9 p -62.49 -31.08 71.77 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.223 -0.923 . . . . 0.0 112.24 169.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -77.23 -47.04 21.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.41 1.084 . . . . 0.0 111.607 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -57.53 -35.56 70.45 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.879 1.672 . . . . 0.0 112.552 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.04 89.89 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 169.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 tpt -65.16 -43.25 92.39 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.636 1.175 . . . . 0.0 111.606 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.61 93.51 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.654 0.782 . . . . 0.0 112.368 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.9 mt -58.6 -41.32 85.55 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.217 0.607 . . . . 0.0 112.404 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.25 -33.14 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-N 118.961 0.8 . . . . 0.0 112.699 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -18.16 63.64 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.631 1.173 . . . . 0.0 113.197 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 tt -95.96 -39.6 9.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.345 2.258 . . . . 0.0 111.899 179.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 122.16 16.92 3.81 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.614 1.102 . . . . 0.0 115.715 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -103.02 48.4 0.86 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.746 1.619 . . . . 0.0 110.319 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -55.09 -38.1 67.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.665 1.586 . . . . 0.0 112.147 -174.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.6 m -65.97 -20.44 66.2 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 113.285 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -81.62 -40.26 23.23 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.874 -1.141 . . . . 0.0 110.978 169.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.95 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.5 pt -62.09 -33.04 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.742 0.701 . . . . 0.0 112.632 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.5 tm0? -75.83 -43.94 43.48 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.124 0.569 . . . . 0.0 111.669 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.9 tpp -54.76 -39.04 67.94 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.969 0.804 . . . . 0.0 112.568 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.36 -40.76 91.92 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.196 -0.94 . . . . 0.0 113.018 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -76.12 -28.48 57.48 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.27 1.028 . . . . 0.0 112.482 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.15 -32.47 70.47 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.851 0.86 . . . . 0.0 112.245 166.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.57 -25.45 60.81 Favored Glycine 0 CA--C 1.536 1.364 0 O-C-N 120.321 -1.487 . . . . 0.0 113.942 174.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.86 -21.33 28.54 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.33 1.565 . . . . 0.0 112.958 166.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -72.31 4.23 3.9 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 125.556 1.542 . . . . 0.0 115.032 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -124.09 29.09 6.54 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.468 2.307 . . . . 0.0 111.947 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -127.0 12.12 7.16 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -163.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.1 p -71.55 -7.48 47.89 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -169.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.7 t -132.86 157.12 45.84 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.016 1.726 . . . . 0.0 112.135 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -48.65 -33.07 9.29 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.339 1.855 . . . . 0.0 112.84 173.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -55.94 -19.45 12.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.448 1.499 . . . . 0.0 114.065 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -131.79 17.07 4.73 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 112.453 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.5 p -71.96 -32.47 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 120.066 -1.646 . . . . 0.0 112.891 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.68 -35.32 70.24 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.239 -0.913 . . . . 0.0 111.405 171.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.1 mm -59.84 -37.37 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.988 1.715 . . . . 0.0 112.108 168.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -58.5 -33.61 70.01 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.401 1.0 . . . . 0.0 112.469 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -77.86 -41.59 36.29 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.699 0.8 . . . . 0.0 112.774 167.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -66.34 -16.99 64.5 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -92.83 -36.64 12.73 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.933 1.242 . . . . 0.0 114.051 161.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -73.1 -30.99 64.05 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.773 1.624 . . . . 0.0 113.727 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -31.17 63.89 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.592 1.087 . . . . 0.0 111.531 167.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -63.48 -34.13 77.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.121 -0.987 . . . . 0.0 111.807 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.74 -44.35 96.42 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.111 0.964 . . . . 0.0 112.079 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -68.7 -33.05 73.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.868 1.267 . . . . 0.0 111.943 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.36 -14.51 46.17 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 174.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.85 -46.27 65.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.905 1.684 . . . . 0.0 111.194 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -74.11 -6.49 47.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.75 -49.77 6.36 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.592 1.568 . . . . 0.0 113.66 162.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.89 -27.48 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.028 2.131 . . . . 0.0 113.69 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.76 -19.45 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.357 1.063 . . . . 0.0 112.569 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.96 -159.07 43.28 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 125.839 1.685 . . . . 0.0 113.765 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.5 m 60.82 27.73 17.52 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.993 1.317 . . . . 0.0 114.347 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.8 t -75.15 150.09 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 125.302 1.441 . . . . 0.0 112.396 -173.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -130.51 -179.86 5.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.718 2.007 . . . . 0.0 113.633 -175.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mt 55.31 57.35 10.85 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.551 2.34 . . . . 0.0 112.69 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.35 3.76 3.9 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.056 2.504 . . . . 0.0 114.52 -178.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.484 HG12 ' H ' ' A' ' 99' ' ' VAL . 1.8 t 54.54 -143.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 125.115 1.366 . . . . 0.0 109.561 -164.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.484 ' H ' HG12 ' A' ' 98' ' ' VAL . 3.2 t 55.49 51.4 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 126.124 1.77 . . . . 0.0 112.476 170.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 67.31 -53.75 0.48 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 128.387 2.675 . . . . 0.0 116.981 162.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 31.0 m -149.78 1.43 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.719 1.608 . . . . 0.0 113.597 -167.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -66.73 -34.1 77.11 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -157.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -151.23 -70.2 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.221 1.009 . . . . 0.0 109.185 159.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.8 mt 62.97 152.12 0.11 Allowed Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 127.952 2.501 . . . . 0.0 115.928 170.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.74 123.41 8.5 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.82 2.347 . . . . 0.0 111.28 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 50.15 23.64 1.21 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.832 2.053 . . . . 0.0 115.787 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.35 54.8 31.67 Favored Glycine 0 CA--C 1.531 1.051 0 O-C-N 120.897 -1.127 . . . . 0.0 113.035 -171.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -45.26 -41.72 8.85 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.956 2.103 . . . . 0.0 115.697 -173.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.35 4.7 52.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.803 1.183 . . . . 0.0 113.862 -171.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -61.28 151.98 30.37 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.041 -1.037 . . . . 0.0 111.169 167.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 C--O 1.255 1.353 0 C-N-CA 124.738 1.215 . . . . 0.0 113.042 -178.301 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.48 1.056 0 CA-C-O 118.871 -0.585 . . . . 0.0 111.994 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 50.1 49.48 20.33 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.711 1.204 . . . . 0.0 112.856 -174.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -118.59 166.79 12.3 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.862 -1.149 . . . . 0.0 112.884 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 95.8 t -23.8 122.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 130.213 3.405 . . . . 0.0 114.044 172.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 35.8 t70 . . . . . 0 C--O 1.251 1.159 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -160.987 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 p -64.8 -37.03 86.24 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.73 -41.11 99.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.154 0.888 . . . . 0.0 111.349 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.15 -38.65 72.23 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.47 -0.769 . . . . 0.0 112.9 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.58 -24.51 64.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.277 1.031 . . . . 0.0 113.379 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -73.53 -63.0 1.29 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.592 1.157 . . . . 0.0 111.378 160.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -60.83 -30.62 70.2 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -163.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -65.55 -37.42 86.65 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.101 0.96 . . . . 0.0 112.942 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -92.41 -31.33 15.34 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.558 1.072 . . . . 0.0 112.122 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -49.37 -39.56 32.56 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.313 1.445 . . . . 0.0 111.674 166.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -52.77 -43.2 60.13 Favored Glycine 0 CA--C 1.537 1.444 0 O-C-N 121.435 -0.791 . . . . 0.0 113.972 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -70.51 -38.78 74.33 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.199 1.499 . . . . 0.0 111.956 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -63.72 -31.94 73.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.278 1.031 . . . . 0.0 112.502 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.83 -37.59 79.26 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.587 -1.321 . . . . 0.0 112.332 175.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.48 -32.61 73.53 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.422 1.01 . . . . 0.0 112.245 165.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.0 10.8 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.53 1.932 . . . . 0.0 114.947 174.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -120.54 -44.55 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.781 1.633 . . . . 0.0 110.732 165.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.69 -1.68 3.61 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.19 1.376 . . . . 0.0 114.821 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.0 mt -87.26 53.56 2.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.466 1.906 . . . . 0.0 111.244 -170.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -53.71 -35.93 61.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.012 1.325 . . . . 0.0 113.36 -173.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -75.21 -33.65 61.4 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.188 0.904 . . . . 0.0 112.176 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -75.44 -29.76 59.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.167 0.894 . . . . 0.0 112.248 168.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.7 -44.55 89.88 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.127 -0.983 . . . . 0.0 111.861 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.9 t -62.83 -42.01 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.928 0.891 . . . . 0.0 111.02 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -54.28 -40.37 67.78 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.63 0.65 . . . . 0.0 112.717 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.9 m -68.97 -38.85 79.63 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.952 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.18 -35.68 76.54 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.512 1.506 . . . . 0.0 111.361 172.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.61 -22.3 65.36 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.291 1.036 . . . . 0.0 112.582 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.87 -47.92 73.29 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.904 0.775 . . . . 0.0 111.391 167.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -36.76 76.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.123 0.874 . . . . 0.0 110.619 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 55.7 mt -74.55 -21.92 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.024 0.829 . . . . 0.0 112.277 177.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.2 m -79.18 -41.66 27.87 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.431 -1.418 . . . . 0.0 111.85 171.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.19 -25.16 29.74 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -137.99 63.95 39.55 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 125.475 1.51 . . . . 0.0 111.189 -175.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -64.07 -12.1 30.67 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.76 2.973 . . . . 0.0 118.567 -165.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -122.08 3.98 9.86 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.037 0.935 . . . . 0.0 112.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.0 123.34 82.15 Favored Pre-proline 0 CA--C 1.544 0.742 0 O-C-N 120.391 -1.443 . . . . 0.0 110.329 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -63.43 -11.34 25.34 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.364 2.043 . . . . 0.0 114.461 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -53.61 -36.2 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.034 0.834 . . . . 0.0 112.42 167.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.9 -50.86 16.86 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 121.485 -0.76 . . . . 0.0 112.351 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -61.65 -40.96 96.76 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.022 0.929 . . . . 0.0 112.587 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.6 p -70.24 -21.64 62.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.091 -1.006 . . . . 0.0 113.615 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.74 -46.27 19.29 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.684 0.794 . . . . 0.0 111.412 170.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.28 -41.35 84.15 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.969 0.907 . . . . 0.0 112.568 173.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.82 -32.0 70.24 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -68.93 -44.56 72.82 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.627 -0.67 . . . . 0.0 111.127 172.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.18 82.49 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.757 0.823 . . . . 0.0 112.818 177.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.09 -47.0 81.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.364 0.666 . . . . 0.0 111.582 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.59 -29.48 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.487 1.04 . . . . 0.0 112.991 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.21 0.23 33.35 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.33 12.32 7.01 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.636 1.974 . . . . 0.0 113.687 171.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.39 15.79 79.31 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.494 1.357 . . . . 0.0 116.494 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -91.9 44.47 1.17 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.827 1.651 . . . . 0.0 112.452 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.0 -37.3 68.95 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.36 1.064 . . . . 0.0 113.03 -175.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 62.4 m -62.46 -30.06 70.98 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.88 1.272 . . . . 0.0 112.52 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -87.38 -29.32 21.6 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.001 0.52 . . . . 0.0 111.149 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.29 -41.4 73.4 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.306 1.042 . . . . 0.0 113.059 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.8 pt -60.64 -34.45 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.138 0.881 . . . . 0.0 112.029 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -68.43 -51.49 43.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.587 0.755 . . . . 0.0 111.373 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.88 -29.29 70.49 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -66.65 -43.59 84.2 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.044 -1.035 . . . . 0.0 111.998 174.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -67.99 -36.95 80.87 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.724 0.693 . . . . 0.0 111.563 175.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.62 -32.88 73.04 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.3 -0.875 . . . . 0.0 112.845 168.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.09 -23.33 66.43 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.493 -1.38 . . . . 0.0 114.402 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.47 -20.02 65.94 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.499 1.65 . . . . 0.0 112.944 171.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -65.92 -5.45 9.34 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.529 1.532 . . . . 0.0 114.58 169.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -122.37 50.25 1.5 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.913 2.085 . . . . 0.0 110.664 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -136.17 4.27 2.94 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -67.09 -29.98 69.9 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -164.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.2 p -113.1 166.27 11.58 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.115 1.366 . . . . 0.0 112.668 -169.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.01 -30.83 64.53 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.06 16.42 0.16 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -133.18 10.26 4.14 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.485 1.514 . . . . 0.0 113.577 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.4 m -63.77 -30.26 49.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 O-C-N 120.503 -1.373 . . . . 0.0 114.123 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.9 -37.23 24.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.734 0.697 . . . . 0.0 111.24 173.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -55.29 -43.98 73.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.336 1.055 . . . . 0.0 111.293 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 49.8 ttp85 -60.32 -40.12 89.45 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.082 0.953 . . . . 0.0 112.046 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -66.75 -46.54 75.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.04 0.936 . . . . 0.0 112.678 170.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -51.73 -57.52 9.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.171 0.896 . . . . 0.0 111.394 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -67.22 -28.24 67.91 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.825 1.193 . . . . 0.0 113.562 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -74.3 -45.89 44.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.848 1.204 . . . . 0.0 112.81 174.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -33.21 73.06 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.039 1.29 . . . . 0.0 111.646 176.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.9 mmt-85 -55.65 -36.96 67.61 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.42 1.009 . . . . 0.0 112.064 171.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 20.1 tp -70.01 -44.14 69.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.142 0.883 . . . . 0.0 111.92 178.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -63.96 -30.29 71.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.047 0.939 . . . . 0.0 112.983 172.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.89 -20.22 23.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.56 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.778 1.626 . . . . 0.0 110.327 168.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -69.56 -16.67 63.46 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 171.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.71 -52.22 7.39 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 125.627 1.584 . . . . 0.0 113.382 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.4 -36.41 66.02 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.598 1.559 . . . . 0.0 112.444 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.26 -31.72 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.353 0.661 . . . . 0.0 112.212 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 62.47 -95.77 0.13 Allowed Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.431 1.015 . . . . 0.0 113.096 -175.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m -62.68 151.38 38.44 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.092 1.757 . . . . 0.0 114.83 -168.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -75.77 35.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 126.244 1.818 . . . . 0.0 113.148 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 -1.19 56.73 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.398 1.879 . . . . 0.0 113.879 -165.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.7 mp -127.72 79.82 72.96 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.471 1.509 . . . . 0.0 109.274 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -89.13 -11.2 3.75 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.489 2.793 . . . . 0.0 113.425 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.5 t 56.45 34.55 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 126.654 1.982 . . . . 0.0 114.144 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 40.9 t -140.44 108.46 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.818 1.247 . . . . 0.0 111.862 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 48.4 -107.3 0.21 Allowed 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.822 2.156 . . . . 0.0 116.822 162.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.2 t -142.74 117.43 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 125.507 1.523 . . . . 0.0 111.537 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -165.82 -77.5 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.477 1.911 . . . . 0.0 109.304 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -147.46 112.98 5.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.523 2.329 . . . . 0.0 107.489 165.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 mp -143.08 167.13 16.8 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.808 2.043 . . . . 0.0 111.31 -168.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -54.6 160.87 6.53 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.421 2.748 . . . . 0.0 114.573 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -58.0 144.45 39.61 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.128 1.371 . . . . 0.0 111.914 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.62 -14.98 0.67 Allowed Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.605 1.402 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -67.51 121.19 15.29 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.785 1.793 . . . . 0.0 110.572 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 t70 60.93 10.44 2.78 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.716 2.006 . . . . 0.0 115.115 -170.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.39 141.84 48.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.364 1.466 . . . . 0.0 112.342 -168.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.251 1.139 0 C-N-CA 126.695 1.998 . . . . 0.0 113.922 -173.406 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 21.1 mmt . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 121.327 0.584 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -134.21 38.13 3.15 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.706 1.202 . . . . 0.0 112.241 172.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -75.62 41.43 0.2 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.555 1.542 . . . . 0.0 113.139 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 12.1 p -73.47 -28.61 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -161.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.783 1.633 . . . . 0.0 113.625 -175.8 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 37.1 mtt . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.1 m -57.62 -36.88 72.39 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -63.6 -20.16 65.43 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.731 -1.231 . . . . 0.0 113.588 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -15.49 49.33 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -74.17 -52.19 13.24 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 157.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.08 -39.8 60.27 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.265 1.026 . . . . 0.0 112.5 -176.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -72.27 -28.34 63.05 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -81.79 -34.65 30.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.218 1.372 . . . . 0.0 112.708 173.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -75.94 -41.06 52.77 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.123 0.969 . . . . 0.0 111.222 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -59.82 -39.4 84.93 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.867 0.867 . . . . 0.0 111.275 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.18 -50.62 51.11 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-N 119.108 0.867 . . . . 0.0 112.477 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -66.24 -40.81 90.5 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.315 1.057 . . . . 0.0 111.601 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 t -57.52 -43.11 84.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.421 1.088 . . . . 0.0 112.668 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.7 mt -67.2 -35.61 79.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.92 1.288 . . . . 0.0 112.142 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -70.3 -28.13 64.94 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 172.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.86 -14.34 61.47 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.283 1.033 . . . . 0.0 112.79 171.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -98.63 -53.87 3.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.873 1.269 . . . . 0.0 112.793 176.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.65 14.95 0.99 Allowed Glycine 0 CA--C 1.537 1.46 0 N-CA-C 115.364 0.906 . . . . 0.0 115.364 -172.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.0 mt -101.61 58.01 0.85 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.285 1.834 . . . . 0.0 110.21 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.99 -36.82 85.24 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.8 1.24 . . . . 0.0 113.499 -168.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.63 -33.19 27.95 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.227 0.921 . . . . 0.0 111.279 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -63.49 -39.99 95.89 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.15 0.432 . . . . 0.0 110.558 167.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.55 -45.88 77.95 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.491 -0.755 . . . . 0.0 112.757 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.06 -35.43 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.199 173.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -61.12 -44.75 96.85 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.857 1.208 . . . . 0.0 112.166 172.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.0 m -60.14 -39.94 88.11 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.841 0.856 . . . . 0.0 112.674 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -75.0 -38.14 61.68 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 175.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -62.49 -32.21 73.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.264 0.938 . . . . 0.0 111.452 172.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -69.36 -26.73 64.82 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 174.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.49 -42.6 78.59 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.988 1.267 . . . . 0.0 110.552 166.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.6 mt -80.93 -21.39 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.022 1.329 . . . . 0.0 111.642 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.1 m -66.29 -44.38 83.67 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.241 -1.537 . . . . 0.0 110.735 168.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.77 -19.9 31.88 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.867 1.267 . . . . 0.0 114.355 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -141.45 68.6 26.05 Favored Pre-proline 0 CA--C 1.556 1.181 0 C-N-CA 125.49 1.516 . . . . 0.0 111.143 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -67.18 -22.01 47.55 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.866 2.378 . . . . 0.0 117.037 -167.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.2 tp60 -100.18 -27.12 13.68 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.616 1.166 . . . . 0.0 111.794 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -69.51 138.18 88.68 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 123.865 0.866 . . . . 0.0 112.872 -171.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.28 -20.83 62.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.909 2.406 . . . . 0.0 113.935 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -46.22 -59.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 125.244 1.418 . . . . 0.0 112.222 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.51 -34.86 85.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 118.95 -0.917 . . . . 0.0 113.432 -172.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -62.62 -42.4 99.57 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.897 1.349 . . . . 0.0 111.285 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.7 p -67.06 -25.44 66.25 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -85.19 -38.82 18.53 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.931 0.892 . . . . 0.0 112.056 172.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -63.32 -31.29 72.4 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.1 -1.625 . . . . 0.0 112.173 173.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.26 -38.61 84.04 Favored 'General case' 0 CA--C 1.548 0.904 0 O-C-N 121.007 -1.058 . . . . 0.0 113.364 169.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -64.12 -43.46 95.2 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.74 0.816 . . . . 0.0 111.17 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.96 79.43 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.334 0.654 . . . . 0.0 111.878 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.75 -38.93 92.49 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.503 -0.748 . . . . 0.0 112.751 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.4 pt -75.79 -25.86 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 CA-C-N 120.111 1.323 . . . . 0.0 113.831 174.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -19.96 39.11 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.913 1.285 . . . . 0.0 113.143 175.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 tt -80.41 -43.52 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.687 1.595 . . . . 0.0 109.854 165.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.79 32.36 4.47 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.242 0.925 . . . . 0.0 113.802 -175.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -101.71 57.42 0.83 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.761 1.624 . . . . 0.0 109.232 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -59.33 -35.05 73.11 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.494 -0.754 . . . . 0.0 111.917 -170.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 88.4 m -62.08 -29.91 70.64 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.114 0.966 . . . . 0.0 112.785 174.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -81.57 -34.54 31.01 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 111.453 171.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.36 98.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.24 -0.913 . . . . 0.0 112.881 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.9 pt -64.33 -30.44 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.299 0.639 . . . . 0.0 112.681 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -71.08 -51.21 26.52 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.475 0.71 . . . . 0.0 110.767 170.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.6 ttm -63.51 -34.04 76.9 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -175.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.3 m -69.76 -42.64 73.58 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.17 -0.956 . . . . 0.0 112.053 175.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.17 -37.16 80.68 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.011 0.823 . . . . 0.0 112.078 177.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.43 -39.92 92.53 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.332 1.053 . . . . 0.0 111.867 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.41 -23.92 77.49 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.229 -1.544 . . . . 0.0 114.233 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.2 mt -66.93 -25.75 66.51 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.959 1.379 . . . . 0.0 112.348 169.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.78 -48.34 82.06 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.142 0.883 . . . . 0.0 111.24 170.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -64.24 -28.1 69.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.255 1.022 . . . . 0.0 113.351 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.5 p -118.64 -1.4 11.15 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -158.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -78.68 49.79 0.92 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.579 1.152 . . . . 0.0 112.825 177.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 t -157.46 153.46 27.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.622 1.569 . . . . 0.0 112.025 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.06 -35.59 25.8 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -164.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.52 -2.82 47.67 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -133.62 12.26 4.08 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.957 1.703 . . . . 0.0 113.098 -173.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.49 -24.86 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.74 -37.22 59.53 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.427 1.012 . . . . 0.0 111.133 171.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mm -65.6 -33.86 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.284 1.033 . . . . 0.0 111.186 173.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -57.41 -44.5 84.65 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.909 1.284 . . . . 0.0 111.401 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 m -66.55 -34.5 78.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.923 0.889 . . . . 0.0 112.56 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -68.9 -0.6 5.75 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 170.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.98 -33.39 6.93 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 117.522 -1.228 . . . . 0.0 113.405 156.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -54.6 -54.64 38.69 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.238 1.835 . . . . 0.0 112.092 173.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -30.17 67.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 122.08 -0.388 . . . . 0.0 111.452 -172.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -64.83 -40.3 94.96 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.35 -0.844 . . . . 0.0 111.563 170.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.57 -30.75 68.61 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.968 0.907 . . . . 0.0 112.159 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -68.69 -47.45 66.41 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.006 0.523 . . . . 0.0 112.063 165.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.88 -16.09 62.67 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.095 -1.003 . . . . 0.0 113.694 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.46 93.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.437 1.471 . . . . 0.0 111.327 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.58 -27.47 65.14 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 121.47 0.652 . . . . 0.0 112.038 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.67 -47.15 42.61 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.349 1.452 . . . . 0.0 112.782 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.17 -32.68 44.3 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.02 1.728 . . . . 0.0 113.218 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.9 p -71.41 -33.2 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.953 0.797 . . . . 0.0 111.112 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.4 21.44 4.37 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.484 1.516 . . . . 0.0 114.661 171.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.4 m -125.73 20.74 7.77 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.342 1.457 . . . . 0.0 113.582 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.8 m -90.72 142.35 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.863 0.865 . . . . 0.0 112.097 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -109.75 177.89 4.59 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.681 1.592 . . . . 0.0 112.714 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 13.1 mt 66.93 86.86 0.12 Allowed Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 126.796 2.038 . . . . 0.0 110.189 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -71.41 -15.97 31.06 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.185 1.923 . . . . 0.0 113.413 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 t 65.46 46.56 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 125.276 1.43 . . . . 0.0 112.023 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 28.8 m -133.61 170.78 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.908 1.283 . . . . 0.0 112.12 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -78.82 -36.16 43.0 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.681 0.792 . . . . 0.0 112.536 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -138.47 125.73 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 122.034 0.921 . . . . 0.0 112.882 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.69 -135.37 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.978 2.511 . . . . 0.0 106.545 160.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -87.53 -39.52 15.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.354 1.434 . . . . 0.0 111.103 171.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.8 mt 62.4 143.03 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 129.46 3.104 . . . . 0.0 114.856 166.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.94 122.94 6.02 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.69 2.26 . . . . 0.0 111.644 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 46.29 42.07 9.84 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.068 1.347 . . . . 0.0 112.767 -174.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.77 -43.2 2.57 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.821 1.677 . . . . 0.0 116.013 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 56.0 t80 59.16 -41.45 0.07 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 128.433 2.693 . . . . 0.0 117.055 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -133.29 121.16 22.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.902 2.081 . . . . 0.0 110.073 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mmt-85 -143.81 154.82 43.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.807 1.643 . . . . 0.0 110.988 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 72.5 m . . . . . 0 C--O 1.247 0.961 0 C-N-CA 126.127 1.771 . . . . 0.0 111.973 176.663 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.13 166.86 11.2 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.872 2.069 . . . . 0.0 114.318 -167.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.62 154.0 51.71 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.355 1.862 . . . . 0.0 110.674 163.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.98 139.13 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.063 -1.023 . . . . 0.0 113.55 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.642 2.377 . . . . 0.0 110.214 172.123 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.754 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.9 p -121.78 -16.39 7.67 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -173.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -64.0 -30.5 71.57 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 121.409 1.913 . . . . 0.0 112.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -13.2 59.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 174.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -77.81 -48.33 16.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 120.96 -1.087 . . . . 0.0 108.636 163.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -46.74 65.04 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.256 1.022 . . . . 0.0 111.974 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -66.92 -25.96 66.62 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.5 ptpp? -86.95 -30.97 20.91 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.987 1.267 . . . . 0.0 113.589 174.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -76.92 -31.85 56.95 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.968 0.803 . . . . 0.0 111.185 173.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -57.66 -52.62 64.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.624 1.57 . . . . 0.0 110.776 159.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.13 -45.97 71.59 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.175 0.898 . . . . 0.0 113.746 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -56.86 -52.09 66.47 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.936 1.294 . . . . 0.0 111.479 173.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.4 m -60.15 -47.88 84.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.9 0.88 . . . . 0.0 111.379 -178.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -55.71 -35.65 66.32 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.727 1.211 . . . . 0.0 112.044 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -66.48 -41.66 88.64 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 120.069 1.304 . . . . 0.0 113.997 173.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -42.19 99.37 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 119.262 0.937 . . . . 0.0 111.833 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -72.35 -25.16 61.43 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.85 12.88 15.08 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.263 1.411 . . . . 0.0 116.055 171.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.2 mt -97.81 61.8 1.59 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.93 2.092 . . . . 0.0 111.047 -174.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -59.26 -30.52 68.35 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.642 1.177 . . . . 0.0 113.986 -175.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -84.31 -32.24 24.44 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.015 -1.053 . . . . 0.0 111.463 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -65.61 -42.79 91.21 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.821 164.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.08 -48.49 70.8 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.479 -0.763 . . . . 0.0 112.405 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 49.6 t -60.34 -33.48 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.574 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -59.68 -43.69 93.9 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.026 1.285 . . . . 0.0 112.592 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.3 m -70.3 -34.03 72.24 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.721 -0.612 . . . . 0.0 112.313 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -72.89 -40.2 65.75 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.877 0.871 . . . . 0.0 112.901 172.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -58.76 -36.06 73.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.546 1.138 . . . . 0.0 111.263 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.33 -14.45 60.1 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.67 -39.98 95.68 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.13 1.332 . . . . 0.0 110.251 161.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.9 mt -75.56 -44.59 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 m -60.1 -33.47 72.15 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.771 1.169 . . . . 0.0 112.286 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.39 -22.09 44.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -144.55 61.12 8.28 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.085 1.354 . . . . 0.0 111.802 -170.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -64.99 -20.52 64.05 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.353 2.035 . . . . 0.0 117.164 -158.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -113.27 3.26 15.88 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.074 0.95 . . . . 0.0 112.237 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -82.01 127.12 73.11 Favored Pre-proline 0 CA--C 1.541 0.608 0 O-C-N 120.717 -1.239 . . . . 0.0 111.613 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.39 -14.79 44.38 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 122.347 2.031 . . . . 0.0 113.806 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.58 -36.98 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-N 119.739 1.154 . . . . 0.0 112.287 170.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.38 -50.16 28.22 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 121.099 -1.0 . . . . 0.0 111.717 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -66.73 -38.56 86.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.303 1.041 . . . . 0.0 112.967 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.7 p -69.58 -14.46 62.85 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 173.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -91.81 -41.4 10.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.276 1.031 . . . . 0.0 111.946 168.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.37 -36.77 83.3 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.793 -1.192 . . . . 0.0 112.396 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.76 -35.3 76.05 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.327 -0.858 . . . . 0.0 113.021 170.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.6 tpt -68.85 -41.87 77.88 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.828 0.851 . . . . 0.0 111.657 175.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -46.11 84.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.746 0.819 . . . . 0.0 111.286 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.6 mt -59.57 -35.82 75.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.66 0.784 . . . . 0.0 112.951 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.5 pt -84.07 -17.78 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.01 -14.92 53.05 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.674 1.19 . . . . 0.0 112.429 168.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.5 tt -94.3 -50.61 5.18 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.924 2.489 . . . . 0.0 111.579 175.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.88 15.95 2.51 Favored Glycine 0 CA--C 1.54 1.646 0 N-CA-C 116.4 1.32 . . . . 0.0 116.4 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -105.31 53.69 0.71 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.413 1.485 . . . . 0.0 110.002 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.87 -29.55 69.61 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.032 -1.042 . . . . 0.0 112.998 -173.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.5 m -60.74 -29.8 69.6 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.953 0.797 . . . . 0.0 111.912 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -76.36 -36.33 58.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.106 0.562 . . . . 0.0 111.445 172.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.32 -37.93 74.83 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.8 pt -65.08 -33.32 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.896 0.771 . . . . 0.0 111.973 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.0 tm0? -68.6 -45.8 71.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.45 0.7 . . . . 0.0 110.818 171.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.9 ttm -73.77 -31.2 63.18 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -173.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.9 m -66.76 -39.91 88.04 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.907 -1.121 . . . . 0.0 111.464 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -67.48 -37.66 83.23 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.442 -0.786 . . . . 0.0 112.008 173.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.32 -31.93 72.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.284 0.634 . . . . 0.0 111.989 171.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.93 -24.56 64.06 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 120.241 1.382 . . . . 0.0 114.391 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.4 mt -62.3 -22.16 65.82 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.648 1.724 . . . . 0.0 112.253 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.68 -2.44 2.45 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 169.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -120.81 40.59 3.5 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.052 1.741 . . . . 0.0 111.665 -175.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 34.3 p -135.9 7.44 3.21 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 116.857 2.169 . . . . 0.0 116.857 -164.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 95.3 p -83.38 19.05 1.62 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -172.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -142.81 144.62 32.63 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.609 1.964 . . . . 0.0 109.61 177.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.79 -9.79 31.65 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.031 0.932 . . . . 0.0 113.465 176.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -59.12 -23.69 62.34 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.399 1.08 . . . . 0.0 112.309 164.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -129.92 24.22 5.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.937 2.095 . . . . 0.0 112.675 -176.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.06 -34.46 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 O-C-N 119.958 -1.714 . . . . 0.0 111.996 173.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.0 79.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.521 -0.737 . . . . 0.0 111.44 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.1 mm -65.13 -37.11 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.43 1.092 . . . . 0.0 111.184 170.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -59.57 -40.21 86.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.702 0.801 . . . . 0.0 111.997 177.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.6 t -70.04 -46.49 64.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.218 1.007 . . . . 0.0 112.162 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -72.05 -3.95 25.94 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -175.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -101.58 -33.13 10.04 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.064 1.302 . . . . 0.0 113.705 158.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -67.75 -49.71 61.04 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 120.381 1.446 . . . . 0.0 112.723 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -34.17 77.31 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.878 1.217 . . . . 0.0 111.19 174.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -65.04 -31.65 72.99 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.86 -1.15 . . . . 0.0 112.116 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.9 tp -71.63 -37.96 70.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.299 1.04 . . . . 0.0 112.774 169.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.03 -36.92 83.05 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.757 -0.589 . . . . 0.0 111.438 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.56 -25.49 35.8 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.889 -1.132 . . . . 0.0 113.259 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.72 99.89 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.47 1.486 . . . . 0.0 111.408 167.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -64.63 -27.18 68.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.801 0.84 . . . . 0.0 112.211 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.52 -46.04 57.09 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 125.688 1.613 . . . . 0.0 113.605 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.64 -28.79 61.02 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.6 1.16 . . . . 0.0 113.094 -177.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.7 p -80.44 -24.32 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -94.79 -157.76 32.79 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 124.177 0.894 . . . . 0.0 112.602 171.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -136.42 145.98 45.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.871 0.868 . . . . 0.0 112.849 165.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 1.3 t 46.22 37.8 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 126.79 2.036 . . . . 0.0 112.949 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -70.21 115.71 9.72 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.969 1.308 . . . . 0.0 110.525 -171.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.557 ' H ' ' HD3' ' A' ' 105' ' ' PRO . 4.0 mp 56.54 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.141 1.776 . . . . 0.0 109.567 -155.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -79.13 -4.19 13.66 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.883 3.055 . . . . 0.0 112.551 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 t 64.53 45.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.476 1.11 . . . . 0.0 111.826 172.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 17.2 m -140.13 44.25 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.168 2.187 . . . . 0.0 111.059 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 50.07 -136.19 1.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.91 1.284 . . . . 0.0 112.032 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 33.6 m -87.63 6.95 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 -168.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -51.14 -40.85 59.47 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.484 1.514 . . . . 0.0 114.191 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -135.84 -58.58 0.76 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.864 1.266 . . . . 0.0 112.554 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.4 mt 50.89 163.21 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 128.514 2.726 . . . . 0.0 117.84 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.557 ' HD3' ' H ' ' A' ' 96' ' ' ILE . 68.4 Cg_endo -88.27 -20.9 1.66 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 124.241 3.294 . . . . 0.0 115.236 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -152.31 170.81 19.13 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.832 1.253 . . . . 0.0 111.854 -162.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.8 56.69 0.15 Allowed Glycine 0 CA--C 1.539 1.56 0 C-N-CA 126.316 1.912 . . . . 0.0 113.567 164.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -98.36 175.56 6.01 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.8 2.44 . . . . 0.0 112.171 -169.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.35 45.2 23.28 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.434 1.094 . . . . 0.0 113.338 175.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -75.84 49.6 0.53 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.805 2.042 . . . . 0.0 113.874 -173.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--O 1.253 1.262 0 C-N-CA 127.766 2.427 . . . . 0.0 113.217 -173.357 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -112.02 158.31 19.69 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.006 0.922 . . . . 0.0 113.14 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -142.49 -3.98 1.01 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -156.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 45.4 t -144.73 132.08 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.902 1.281 . . . . 0.0 109.704 -174.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 3.7 p30 . . . . . 0 C--O 1.251 1.148 0 C-N-CA 125.098 1.359 . . . . 0.0 113.357 167.359 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.6 mtt . . . . . 0 N--CA 1.477 0.911 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -48.96 -45.59 42.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.0 1.72 . . . . 0.0 114.416 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -69.51 -36.5 76.52 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.548 0.739 . . . . 0.0 110.7 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -63.7 -37.22 86.53 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.425 -0.797 . . . . 0.0 112.835 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -72.21 -17.76 61.9 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.18 -28.32 16.35 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.3 -36.23 68.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.471 1.032 . . . . 0.0 112.512 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -60.1 -33.67 72.43 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.072 0.851 . . . . 0.0 111.344 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.62 -34.02 62.7 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.678 0.791 . . . . 0.0 113.041 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -64.74 -42.83 94.88 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.316 -0.865 . . . . 0.0 111.435 168.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.87 -41.83 99.39 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 121.669 -0.644 . . . . 0.0 112.482 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -58.74 -38.43 78.39 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.784 -0.833 . . . . 0.0 112.544 172.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -68.83 -42.46 77.17 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.683 0.674 . . . . 0.0 111.901 175.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -56.76 -40.45 75.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.868 1.213 . . . . 0.0 112.438 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.428 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 35.4 m-85 -58.14 -39.07 77.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.857 0.753 . . . . 0.0 112.322 171.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.56 65.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -84.86 4.46 33.13 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.226 0.921 . . . . 0.0 113.157 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.75 4.57 90.01 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-O 119.142 -0.81 . . . . 0.0 114.151 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.8 mt -84.62 54.04 2.89 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.313 1.557 . . . . 0.0 111.622 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -57.35 -32.25 66.56 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.897 1.279 . . . . 0.0 113.306 -173.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -83.59 -23.95 31.71 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.336 1.426 . . . . 0.0 113.039 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -75.76 -36.8 59.75 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.277 0.944 . . . . 0.0 111.21 164.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.428 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -75.76 -38.1 58.66 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.428 HG13 ' CE2' ' A' ' 27' ' ' TYR . 33.0 t -64.88 -35.56 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 O-C-N 120.626 -1.296 . . . . 0.0 110.885 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -59.88 -33.36 71.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.032 0.833 . . . . 0.0 112.267 171.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.6 m -64.64 -36.19 83.46 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.465 173.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.428 ' CE2' HG13 ' A' ' 24' ' ' VAL 0.336 0.2 OUTLIER -66.11 -29.82 70.2 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.491 1.496 . . . . 0.0 114.249 -178.826 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.59 -36.12 80.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.317 0.962 . . . . 0.0 112.096 172.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -61.62 -34.15 75.15 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.763 0.711 . . . . 0.0 112.659 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.41 -37.08 85.88 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 121.711 -0.618 . . . . 0.0 110.873 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.7 mt -82.18 -35.81 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 110.444 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.8 m -63.37 -31.66 72.88 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.4 1.454 . . . . 0.0 112.628 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.13 -29.37 57.79 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 169.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -134.65 61.81 50.59 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 124.838 1.255 . . . . 0.0 112.286 -169.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -64.04 -25.4 66.27 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.601 2.201 . . . . 0.0 117.279 -160.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -120.06 23.34 11.05 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.538 1.135 . . . . 0.0 111.728 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -106.44 123.29 39.28 Favored Pre-proline 0 CA--C 1.544 0.734 0 O-C-N 121.182 -0.949 . . . . 0.0 112.824 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.97 -13.64 24.03 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.116 2.544 . . . . 0.0 115.983 174.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.16 -37.77 57.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 120.262 1.392 . . . . 0.0 112.663 166.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.17 -44.49 60.04 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.647 0.658 . . . . 0.0 111.573 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -65.32 -37.73 88.0 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.874 -0.78 . . . . 0.0 111.628 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 37.3 m -59.99 -37.55 80.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.455 1.102 . . . . 0.0 111.884 171.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -81.47 -24.99 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.84 -40.82 92.1 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.971 -1.081 . . . . 0.0 111.614 163.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.25 -38.95 93.15 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.107 0.867 . . . . 0.0 112.596 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.1 tpt -60.41 -43.11 97.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.635 1.174 . . . . 0.0 112.043 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.21 -44.05 95.46 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.561 1.073 . . . . 0.0 112.417 172.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.5 mt -61.39 -44.57 96.92 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.536 0.734 . . . . 0.0 112.419 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -70.27 -29.0 37.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 119.432 1.014 . . . . 0.0 112.716 175.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -10.76 59.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -7.06 23.41 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.798 2.039 . . . . 0.0 112.55 167.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.21 14.21 75.01 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.7 1.143 . . . . 0.0 115.767 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -90.15 51.16 1.98 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.389 1.476 . . . . 0.0 110.769 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -55.35 -37.4 67.44 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.086 1.354 . . . . 0.0 112.467 -173.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.4 m -65.03 -22.84 67.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.993 1.317 . . . . 0.0 113.546 177.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -81.23 -39.5 25.26 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 110.769 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -37.41 87.04 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.596 -0.69 . . . . 0.0 112.707 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.0 pt -63.07 -33.17 59.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 113.127 177.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -72.68 -47.9 43.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.626 0.648 . . . . 0.0 110.969 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 29.0 ttm -63.58 -31.88 73.18 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 82.9 m -69.18 -39.93 78.42 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.121 -0.987 . . . . 0.0 111.798 174.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -69.4 -36.26 76.58 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.449 -0.782 . . . . 0.0 111.256 174.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.75 -30.74 69.06 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.724 -1.235 . . . . 0.0 112.701 167.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.18 -31.69 54.38 Favored Glycine 0 N--CA 1.47 0.913 0 CA-C-N 120.612 1.551 . . . . 0.0 113.573 171.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.54 -28.92 70.27 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.34 1.57 . . . . 0.0 112.325 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -58.3 -16.04 12.65 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -88.65 2.8 52.55 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.223 1.409 . . . . 0.0 113.424 173.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -114.27 80.27 1.37 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -167.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.1 m -134.64 7.07 3.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.943 1.297 . . . . 0.0 114.151 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -143.02 161.13 38.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.389 1.475 . . . . 0.0 112.197 -173.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.0 -5.92 29.79 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -164.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.25 9.71 42.35 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 120.581 -1.324 . . . . 0.0 114.419 173.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -135.96 11.33 3.35 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.1 m -70.13 -35.57 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 120.183 -1.573 . . . . 0.0 114.236 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.47 -29.39 46.8 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.975 -1.078 . . . . 0.0 111.457 171.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.5 mm -58.33 -35.03 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 121.515 -0.741 . . . . 0.0 111.447 165.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttt-85 -57.39 -46.74 83.12 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.441 1.019 . . . . 0.0 110.715 173.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 75.3 m -64.69 -37.31 87.13 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.407 1.083 . . . . 0.0 113.591 171.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -57.18 -48.99 77.37 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.275 0.943 . . . . 0.0 110.842 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.93 -25.59 56.11 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 117.303 -1.332 . . . . 0.0 113.775 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -58.06 -53.8 54.16 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 120.855 1.662 . . . . 0.0 110.41 166.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -30.03 60.78 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -58.42 -37.42 75.33 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.812 1.187 . . . . 0.0 112.103 169.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.92 -39.99 69.08 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.827 0.739 . . . . 0.0 112.098 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -58.02 -39.88 79.45 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.548 -0.72 . . . . 0.0 112.167 169.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.2 -19.46 33.98 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 120.965 -1.084 . . . . 0.0 113.771 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.42 -37.54 77.49 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.488 1.495 . . . . 0.0 111.373 164.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -69.11 -29.4 67.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.951 0.9 . . . . 0.0 111.826 169.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -55.3 13.84 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 126.374 1.94 . . . . 0.0 112.107 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.65 -27.72 65.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.123 1.369 . . . . 0.0 113.637 -174.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p -74.97 -24.52 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 CA-C-N 119.056 0.844 . . . . 0.0 112.61 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.83 -168.53 54.08 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.904 1.24 . . . . 0.0 115.917 170.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.9 t -148.6 173.0 13.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.601 1.56 . . . . 0.0 113.165 -174.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.8 t -67.82 -25.91 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.405 1.082 . . . . 0.0 111.351 161.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -79.07 172.44 13.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.339 1.056 . . . . 0.0 112.933 170.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 mt 54.3 77.02 0.46 Allowed Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 127.41 2.284 . . . . 0.0 110.718 -176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -82.22 -13.48 10.03 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.235 1.956 . . . . 0.0 112.55 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 t 55.3 56.2 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.348 1.859 . . . . 0.0 111.787 -170.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.09 125.83 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.771 1.629 . . . . 0.0 109.089 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 41.53 -122.6 0.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.313 1.845 . . . . 0.0 113.509 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 15.9 m -139.53 -27.87 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.495 1.518 . . . . 0.0 114.066 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.847 1.203 . . . . 0.0 114.234 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -92.47 8.62 37.92 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.996 -1.065 . . . . 0.0 113.206 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.0 mt -116.53 150.18 45.08 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 126.302 1.841 . . . . 0.0 111.724 -173.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -83.18 162.8 15.35 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 124.038 3.158 . . . . 0.0 113.62 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -69.04 145.36 53.58 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 122.223 1.011 . . . . 0.0 112.064 176.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.68 -38.27 3.16 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 125.175 1.369 . . . . 0.0 111.004 -157.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -92.82 -58.4 2.35 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.448 1.124 . . . . 0.0 111.589 173.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -152.25 147.44 26.38 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.129 0.972 . . . . 0.0 110.893 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 37.4 ttp180 -142.26 143.91 33.07 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.874 0.87 . . . . 0.0 111.439 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 C--O 1.252 1.223 0 C-N-CA 124.875 1.27 . . . . 0.0 114.163 -169.728 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -64.32 148.49 50.2 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.39 1.45 . . . . 0.0 114.368 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -126.54 164.94 20.08 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.906 1.683 . . . . 0.0 111.594 -179.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.6 -13.86 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 117.605 2.446 . . . . 0.0 117.605 -166.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 118.687 2.847 . . . . 0.0 118.687 169.917 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ptm . . . . . 0 N--CA 1.476 0.871 0 CA-C-O 118.993 -0.527 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -57.67 -32.3 67.19 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -164.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -62.03 -44.31 96.98 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.493 1.497 . . . . 0.0 111.433 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -40.91 91.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.358 1.063 . . . . 0.0 111.358 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.2 -25.44 67.04 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.172 1.389 . . . . 0.0 113.161 171.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.7 -47.62 18.7 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.129 0.972 . . . . 0.0 111.49 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.66 -31.7 68.72 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -58.58 -35.02 71.73 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.298 0.954 . . . . 0.0 112.991 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.56 -21.25 20.19 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.68 -42.12 98.5 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.561 171.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.84 -36.96 91.73 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-O 119.218 -0.768 . . . . 0.0 114.224 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -57.15 -46.34 82.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.857 1.329 . . . . 0.0 111.989 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -67.54 -43.42 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.153 0.981 . . . . 0.0 111.748 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.21 -42.95 87.32 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.443 -0.786 . . . . 0.0 111.736 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.07 -40.0 83.84 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.918 -1.114 . . . . 0.0 112.447 170.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -33.91 77.04 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.45 1.1 . . . . 0.0 113.659 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.48 -9.49 59.62 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 18.72 55.46 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.046 -1.033 . . . . 0.0 114.621 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 mt -93.28 55.0 2.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.178 2.191 . . . . 0.0 110.002 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 -61.5 -38.89 88.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -167.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.28 -38.47 65.89 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.145 0.884 . . . . 0.0 110.917 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -66.02 -34.86 79.04 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 122.974 0.509 . . . . 0.0 111.967 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.39 -53.15 53.04 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.952 0.501 . . . . 0.0 111.986 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.2 t -63.26 -32.34 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.665 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -53.82 -51.47 63.43 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.175 0.898 . . . . 0.0 111.416 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 99.7 m -57.89 -40.2 79.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.083 0.953 . . . . 0.0 112.204 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.415 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 76.8 m-85 -70.47 -41.25 73.0 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.717 0.689 . . . . 0.0 112.659 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -67.34 -25.52 66.04 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.896 0.771 . . . . 0.0 112.492 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -65.38 -32.0 73.4 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.342 -1.474 . . . . 0.0 111.767 169.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -68.03 -38.75 82.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.075 0.852 . . . . 0.0 110.919 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.9 mm -68.29 -37.23 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.697 0.799 . . . . 0.0 110.595 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.1 m -59.93 -32.49 70.83 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.951 1.3 . . . . 0.0 112.708 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.41 -16.85 20.99 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -138.36 51.56 3.91 Favored Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 123.958 0.903 . . . . 0.0 112.707 -166.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -61.62 -27.09 81.08 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.383 2.055 . . . . 0.0 116.803 -159.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -102.38 0.5 34.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -83.11 118.85 72.94 Favored Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.028 -1.045 . . . . 0.0 112.361 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -54.34 -25.42 39.1 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.079 2.519 . . . . 0.0 114.852 174.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -52.48 -44.61 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.058 0.943 . . . . 0.0 112.376 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -44.83 60.83 Favored Glycine 0 CA--C 1.528 0.876 0 O-C-N 121.56 -0.713 . . . . 0.0 112.359 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -60.78 -33.73 73.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.465 0.706 . . . . 0.0 111.859 173.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.0 t -68.43 -41.63 80.07 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.264 -0.897 . . . . 0.0 113.092 172.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -64.87 -35.37 80.92 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 118.676 0.671 . . . . 0.0 111.294 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -73.37 -31.65 64.05 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.785 -1.197 . . . . 0.0 112.767 175.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.28 93.93 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.868 -1.145 . . . . 0.0 112.224 168.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 43.4 tpp -59.0 -40.5 85.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.051 0.941 . . . . 0.0 111.609 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.89 -45.68 91.74 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.516 -0.74 . . . . 0.0 112.776 174.056 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.9 mt -66.14 -36.35 82.89 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.531 -0.731 . . . . 0.0 112.691 -176.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.6 pt -71.61 -28.8 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.737 1.153 . . . . 0.0 112.966 171.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.34 -20.85 36.49 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 tt -81.16 -32.82 33.49 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.286 1.434 . . . . 0.0 110.528 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.45 21.0 10.22 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.26 1.41 . . . . 0.0 114.842 175.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -96.11 57.86 1.79 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.875 1.338 . . . . 0.0 110.058 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -54.55 -37.86 65.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.854 1.262 . . . . 0.0 112.603 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.72 -23.28 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.245 1.018 . . . . 0.0 112.566 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -87.84 -31.72 19.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.826 0.85 . . . . 0.0 111.884 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -40.3 88.14 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.624 0.769 . . . . 0.0 112.162 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.454 HG22 HD12 ' A' ' 84' ' ' LEU . 34.1 pt -62.2 -38.96 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 118.828 0.74 . . . . 0.0 112.011 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.83 -44.69 92.45 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.688 0.795 . . . . 0.0 111.177 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.5 ttm -65.23 -31.35 72.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.784 0.72 . . . . 0.0 112.928 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.2 m -69.45 -42.82 74.41 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.994 -1.066 . . . . 0.0 111.817 174.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -62.11 -41.53 98.32 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.723 0.692 . . . . 0.0 111.947 172.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -34.95 77.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.453 1.101 . . . . 0.0 111.797 172.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.38 -30.33 56.91 Favored Glycine 0 CA--C 1.532 1.107 0 O-C-N 120.651 -1.28 . . . . 0.0 114.393 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.59 -30.02 68.38 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.58 1.69 . . . . 0.0 111.949 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -63.85 -16.7 61.96 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -92.57 34.71 1.05 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.164 1.385 . . . . 0.0 113.045 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.9 p -144.21 137.78 27.6 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 120.511 -1.368 . . . . 0.0 114.055 -166.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.7 t -163.73 -50.34 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 163.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -85.47 175.73 8.66 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.714 0.806 . . . . 0.0 112.895 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.01 -10.62 51.73 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -170.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -2.03 42.59 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.081 -1.012 . . . . 0.0 113.394 167.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -120.65 -9.46 9.36 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.285 1.434 . . . . 0.0 114.436 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -68.59 -31.21 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 O-C-N 119.845 -1.784 . . . . 0.0 113.535 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.02 -37.67 64.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.19 0.904 . . . . 0.0 111.649 165.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -57.08 -32.91 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.376 -0.828 . . . . 0.0 112.979 175.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.3 mtm180 -61.79 -44.74 96.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.191 0.996 . . . . 0.0 112.006 174.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.3 t -65.66 -38.78 90.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 118.747 0.703 . . . . 0.0 111.485 169.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -73.0 7.26 2.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.42 1.488 . . . . 0.0 114.367 176.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -114.83 -33.25 5.53 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.527 1.058 . . . . 0.0 112.629 153.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -68.13 -41.29 81.9 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 120.455 1.48 . . . . 0.0 114.116 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.59 78.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.434 -1.417 . . . . 0.0 111.191 173.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -60.93 -37.02 80.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.488 -0.758 . . . . 0.0 111.122 174.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.454 HD12 HG22 ' A' ' 58' ' ' ILE . 38.3 tp -70.21 -40.87 74.31 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.067 1.347 . . . . 0.0 112.441 174.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.99 -31.31 72.45 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.39 -0.819 . . . . 0.0 112.609 171.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -88.35 -22.84 23.6 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.25 95.86 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.596 1.544 . . . . 0.0 110.183 165.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -71.59 -31.91 67.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.477 1.111 . . . . 0.0 112.146 173.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.61 -47.18 63.47 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.26 1.409 . . . . 0.0 113.545 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.33 -26.29 60.06 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.261 1.424 . . . . 0.0 113.12 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.4 p -76.33 -33.49 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.022 0.828 . . . . 0.0 112.481 173.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -173.92 145.71 8.33 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-N 119.139 0.881 . . . . 0.0 114.635 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -101.57 146.34 27.81 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.785 1.634 . . . . 0.0 111.624 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.7 m -113.37 24.94 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.302 1.441 . . . . 0.0 113.815 -169.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -62.51 168.46 3.61 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.51 1.124 . . . . 0.0 113.439 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp 60.17 92.58 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 126.426 1.89 . . . . 0.0 109.627 -171.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -81.06 -38.78 0.23 Allowed 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.446 2.097 . . . . 0.0 113.925 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.2 t 51.22 40.86 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-O 122.315 1.055 . . . . 0.0 112.094 -166.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 86.6 t -144.39 115.18 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 127.425 2.29 . . . . 0.0 108.125 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 33.22 -103.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 127.026 2.13 . . . . 0.0 113.843 178.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 35.5 m -136.22 38.97 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 127.175 2.19 . . . . 0.0 111.761 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.67 -36.81 77.19 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -170.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -149.01 -62.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.467 1.107 . . . . 0.0 110.898 167.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 50.8 mt 66.28 130.67 0.03 OUTLIER Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 128.993 2.917 . . . . 0.0 115.33 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.44 131.78 23.98 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.712 2.942 . . . . 0.0 114.254 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 45.75 38.26 4.1 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.885 2.074 . . . . 0.0 115.19 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.16 -100.28 1.35 Allowed Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.405 1.479 . . . . 0.0 112.133 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.7 t80 64.63 12.34 7.46 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 117.891 2.552 . . . . 0.0 117.891 158.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -72.42 145.56 47.57 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.875 -1.765 . . . . 0.0 114.347 178.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 49.93 33.23 6.36 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.77 2.028 . . . . 0.0 113.745 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.253 1.258 0 C-N-CA 127.294 2.237 . . . . 0.0 114.411 -175.675 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -134.11 140.71 46.77 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.792 . . . . 0.0 111.433 175.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -73.74 140.35 45.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.303 1.041 . . . . 0.0 111.653 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 8.4 p -145.95 62.04 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.363 1.465 . . . . 0.0 108.729 174.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 C--O 1.25 1.118 0 C-N-CA 125.545 1.538 . . . . 0.0 113.701 -167.736 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.1 mtm . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -63.25 -12.51 29.41 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.33 1.604 . . . . 0.0 115.33 -173.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -52.67 -30.82 33.92 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.56 1.544 . . . . 0.0 113.242 171.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -92.66 -0.12 57.34 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 175.741 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -97.12 -37.95 9.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.212 1.805 . . . . 0.0 111.582 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -39.5 93.8 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.898 0.772 . . . . 0.0 111.499 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.85 -24.09 62.46 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -172.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -76.45 -36.62 57.82 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.185 -0.947 . . . . 0.0 112.942 171.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -66.24 -36.07 82.07 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.556 0.743 . . . . 0.0 112.261 170.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -63.65 -50.46 69.2 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.236 1.414 . . . . 0.0 111.088 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.84 -40.18 80.05 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.606 -0.684 . . . . 0.0 113.731 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.49 -37.72 83.27 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 118.765 1.282 . . . . 0.0 111.983 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 t -65.06 -46.03 82.89 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.228 0.611 . . . . 0.0 112.113 171.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.9 mt -57.68 -38.9 75.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.257 1.023 . . . . 0.0 111.996 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 50' ' ' LYS . 1.9 m-85 -56.59 -41.36 76.85 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.797 -0.564 . . . . 0.0 112.39 170.12 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -19.43 64.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.534 1.134 . . . . 0.0 113.901 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -91.84 -5.59 53.13 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.587 1.085 . . . . 0.0 113.693 168.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 11.35 72.1 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.15 -0.969 . . . . 0.0 114.526 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.5 mt -83.67 51.12 1.94 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.779 1.631 . . . . 0.0 110.616 175.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -55.76 -36.0 66.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.943 1.697 . . . . 0.0 112.85 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -86.94 -33.69 19.6 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.377 -0.827 . . . . 0.0 112.202 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -62.64 -41.02 98.8 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 118.511 0.596 . . . . 0.0 111.431 164.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.39 80.67 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.46 -35.15 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.729 -0.607 . . . . 0.0 111.205 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -62.63 -39.01 92.48 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.403 1.001 . . . . 0.0 112.029 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -64.77 -44.85 88.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.876 0.871 . . . . 0.0 111.781 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -63.06 -38.4 91.03 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.654 -0.654 . . . . 0.0 112.079 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.11 -26.45 68.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.641 1.176 . . . . 0.0 112.368 171.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -72.45 -27.68 62.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.302 1.41 . . . . 0.0 112.969 172.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.42 -44.0 92.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.728 1.149 . . . . 0.0 110.473 170.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.0 mt -66.32 -44.28 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.916 1.286 . . . . 0.0 110.103 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -61.01 -30.14 70.12 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.24 1.016 . . . . 0.0 112.384 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.77 -28.28 30.46 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 173.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -140.71 65.69 25.54 Favored Pre-proline 0 CA--C 1.562 1.409 0 C-N-CA 126.382 1.873 . . . . 0.0 111.552 -168.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -68.35 -19.19 43.96 Favored 'Trans proline' 0 C--N 1.353 0.806 0 N-CA-C 118.179 2.338 . . . . 0.0 118.179 -161.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -102.73 -8.66 20.67 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.381 -0.824 . . . . 0.0 112.736 177.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -77.3 140.76 65.55 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 121.21 -0.931 . . . . 0.0 112.352 -174.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.33 -9.01 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.541 2.161 . . . . 0.0 113.871 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 p -61.74 -46.16 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.948 -1.095 . . . . 0.0 112.233 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.13 -36.1 64.13 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 120.918 -1.114 . . . . 0.0 113.168 175.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -58.3 -39.68 79.96 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.707 1.254 . . . . 0.0 111.492 169.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.5 m -62.02 -29.98 70.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.716 0.806 . . . . 0.0 112.207 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -87.86 -29.45 20.9 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -63.16 -39.78 95.65 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 121.174 1.807 . . . . 0.0 111.205 165.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -34.1 75.86 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.904 -1.123 . . . . 0.0 112.925 169.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 tpt -63.75 -40.18 96.1 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.604 0.762 . . . . 0.0 111.724 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.94 86.96 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.708 0.685 . . . . 0.0 111.869 171.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -56.56 -41.7 77.32 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.42 1.009 . . . . 0.0 112.294 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.7 pt -76.1 -21.05 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.408 ' HB3' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -95.42 -15.7 22.81 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.031 1.287 . . . . 0.0 114.108 178.334 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.95 -28.4 15.82 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.455 1.902 . . . . 0.0 111.294 169.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CZ ' ' A' ' 54' ' ' TYR . . . 104.0 27.12 6.39 Favored Glycine 0 CA--C 1.531 1.078 0 N-CA-C 115.755 1.062 . . . . 0.0 115.755 173.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.02 54.49 1.12 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.385 1.088 . . . . 0.0 109.927 170.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.415 ' CZ ' ' HA2' ' A' ' 52' ' ' GLY . 7.0 m-85 -58.94 -32.79 69.91 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.726 1.21 . . . . 0.0 113.408 -169.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.8 m -75.12 -22.0 58.51 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.458 -0.776 . . . . 0.0 112.099 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.5 mm-40 -74.47 -36.57 63.31 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.58 -1.325 . . . . 0.0 110.931 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.66 -41.96 91.89 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.649 -0.657 . . . . 0.0 112.537 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.7 pt -61.63 -36.96 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.561 0.619 . . . . 0.0 111.998 176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -66.39 -50.33 63.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.297 1.039 . . . . 0.0 110.804 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.9 ttm -63.8 -32.3 73.77 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.1 -42.41 72.74 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 120.867 -1.145 . . . . 0.0 112.093 175.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -71.73 -33.53 68.8 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.112 0.869 . . . . 0.0 111.79 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.89 -36.86 77.84 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.335 1.054 . . . . 0.0 112.418 164.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.26 -29.8 61.71 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 120.266 -1.521 . . . . 0.0 113.902 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.51 -21.8 62.86 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.558 1.679 . . . . 0.0 112.626 172.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -66.11 -9.18 28.81 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 170.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -109.23 27.75 9.21 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.762 2.025 . . . . 0.0 111.985 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 32.1 p -135.18 -0.78 2.69 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 -166.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 69.5 m -79.44 40.51 0.44 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.831 -1.168 . . . . 0.0 113.014 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 t -150.9 145.57 25.72 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.9 -13.53 11.35 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.981 1.312 . . . . 0.0 114.169 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -70.07 -28.04 65.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.769 1.228 . . . . 0.0 112.416 168.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -134.84 21.4 3.54 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.988 1.715 . . . . 0.0 112.697 -169.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.63 -35.22 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 120.642 -1.286 . . . . 0.0 112.168 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.0 68.19 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.21 -0.931 . . . . 0.0 111.784 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.0 mm -67.68 -31.81 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.154 -0.966 . . . . 0.0 111.018 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -57.2 -40.87 78.3 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.248 -0.908 . . . . 0.0 111.441 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.9 m -76.96 -35.45 57.22 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.351 1.46 . . . . 0.0 113.603 174.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -52.36 -63.46 1.13 Allowed 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.779 1.172 . . . . 0.0 110.74 168.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -70.52 -26.63 63.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.073 0.851 . . . . 0.0 112.737 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.81 -35.31 64.87 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.04 1.291 . . . . 0.0 114.012 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.6 65.48 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.965 1.257 . . . . 0.0 111.343 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 57.3 mmt-85 -56.1 -42.93 77.56 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 119.575 1.08 . . . . 0.0 111.406 170.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.7 tp -67.54 -40.68 85.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.801 1.24 . . . . 0.0 112.469 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.63 -37.08 85.97 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.95 0.5 . . . . 0.0 112.31 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.2 -20.78 31.76 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.64 -47.81 83.14 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.281 1.4 . . . . 0.0 110.669 169.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.541 ' HA ' HG12 ' A' ' 91' ' ' VAL . 4.6 pt20 -76.02 -26.96 57.15 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 173.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -25.94 74.22 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 120.82 -1.175 . . . . 0.0 114.78 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -87.46 -33.7 18.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.92 1.288 . . . . 0.0 112.873 174.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.541 HG12 ' HA ' ' A' ' 88' ' ' GLN . 1.7 p -89.85 -30.49 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -173.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.53 52.18 4.08 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 118.117 2.007 . . . . 0.0 118.117 -152.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 m -67.83 143.97 55.54 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.535 1.168 . . . . 0.0 111.129 164.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 12.7 m -87.13 149.96 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -164.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -149.65 174.61 12.37 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.289 1.435 . . . . 0.0 113.159 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.415 HG22 HG13 ' A' ' 98' ' ' VAL . 9.4 mt 65.19 88.54 0.11 Allowed Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 127.795 2.438 . . . . 0.0 112.36 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.3 -15.02 16.2 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.942 2.428 . . . . 0.0 113.486 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.415 HG13 HG22 ' A' ' 96' ' ' ILE 0.329 15.9 m 55.08 0.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 118.859 2.911 . . . . 0.0 118.859 -177.813 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.01 5.46 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 126.458 1.903 . . . . 0.0 114.296 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -130.57 -175.06 3.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.244 1.418 . . . . 0.0 111.197 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 64.8 t -139.74 -29.97 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.805 1.242 . . . . 0.0 113.227 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -75.05 -27.99 60.22 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 115.921 1.822 . . . . 0.0 115.921 -166.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -104.38 -99.22 0.31 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.709 1.141 . . . . 0.0 109.551 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.1 mp 62.21 167.66 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.262 1.825 . . . . 0.0 112.004 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -77.37 168.17 23.33 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 CA-C-N 120.226 1.116 . . . . 0.0 112.032 166.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -51.95 123.6 10.77 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.525 1.53 . . . . 0.0 112.229 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.4 12.89 70.21 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 117.065 1.586 . . . . 0.0 117.065 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -80.05 -36.27 35.93 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.118 1.459 . . . . 0.0 113.454 -175.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -61.7 154.37 25.6 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 41.4 mtm180 65.23 4.57 2.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.526 1.93 . . . . 0.0 115.647 -177.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 97.3 p . . . . . 0 C--O 1.251 1.177 0 C-N-CA 124.609 1.163 . . . . 0.0 113.65 170.947 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.4 mpt? . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 120.707 0.289 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -101.94 159.32 15.46 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.034 1.334 . . . . 0.0 112.044 168.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -95.33 112.62 24.3 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 109.62 173.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 5.9 p -97.89 -6.03 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 115.127 1.529 . . . . 0.0 115.127 -160.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 125.891 1.676 . . . . 0.0 114.147 179.042 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.5 mtt . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 121.25 0.548 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.9 m -93.98 -25.65 17.16 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.768 1.227 . . . . 0.0 112.394 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -61.96 -47.25 85.69 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.355 1.462 . . . . 0.0 112.029 -176.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -7.66 56.9 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -87.57 -47.85 8.38 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.938 1.295 . . . . 0.0 111.078 170.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -27.73 67.9 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.773 -1.204 . . . . 0.0 112.608 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -28.15 63.7 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.101 1.319 . . . . 0.0 114.042 175.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -76.02 -30.27 58.43 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.687 -1.258 . . . . 0.0 111.369 171.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -71.29 -30.54 66.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 169.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.24 -48.6 81.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.188 0.995 . . . . 0.0 109.743 163.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.2 -38.91 57.39 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.896 0.76 . . . . 0.0 113.738 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.425 ' ND2' ' H ' ' B' ' 0' ' ' ASP . 60.2 t30 -60.51 -47.86 84.32 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.432 1.116 . . . . 0.0 112.317 176.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.8 m -66.3 -36.22 82.4 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.355 0.662 . . . . 0.0 112.599 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -61.14 -44.69 96.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.258 -0.901 . . . . 0.0 111.055 175.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -58.89 -39.73 82.31 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.349 0.977 . . . . 0.0 112.656 169.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -27.93 65.88 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -84.75 -19.74 32.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.454 1.501 . . . . 0.0 113.07 170.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 9.69 38.22 Favored Glycine 0 N--CA 1.477 1.398 0 C-N-CA 125.256 1.408 . . . . 0.0 114.353 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.0 mt -87.41 55.74 3.65 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 127.734 2.414 . . . . 0.0 110.031 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -57.77 -40.2 79.23 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.429 1.092 . . . . 0.0 112.566 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -67.98 -39.34 83.31 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.144 0.884 . . . . 0.0 110.836 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.34 -33.14 71.12 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.255 1.022 . . . . 0.0 113.36 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.26 77.14 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.133 0.879 . . . . 0.0 112.377 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.86 -34.84 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.446 1.099 . . . . 0.0 111.402 174.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 -58.17 -33.85 69.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.286 0.948 . . . . 0.0 112.654 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 70.3 m -69.09 -46.15 68.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.803 0.729 . . . . 0.0 111.524 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -31.59 72.46 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.628 1.104 . . . . 0.0 112.067 174.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.51 -29.51 70.77 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.198 -0.939 . . . . 0.0 112.454 174.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -70.97 -30.45 66.72 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.396 0.998 . . . . 0.0 112.302 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.88 -54.01 47.9 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.849 0.75 . . . . 0.0 110.008 171.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 58.1 mt -73.94 -28.77 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 111.846 -171.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -71.06 -27.21 63.47 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 120.913 -1.117 . . . . 0.0 112.287 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.94 -25.75 27.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 168.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -143.77 78.09 14.49 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.729 1.611 . . . . 0.0 112.213 -166.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -67.1 -22.13 47.89 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.742 2.295 . . . . 0.0 115.575 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -133.98 -11.75 2.59 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -163.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -65.91 128.78 94.06 Favored Pre-proline 0 CA--C 1.547 0.857 0 O-C-N 120.604 -1.31 . . . . 0.0 108.644 164.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.62 -22.45 72.66 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.739 2.292 . . . . 0.0 114.063 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.18 -31.64 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.782 1.633 . . . . 0.0 114.23 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.65 -35.03 62.62 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.153 -0.967 . . . . 0.0 112.214 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -79.01 -37.3 39.5 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.193 0.997 . . . . 0.0 112.279 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.0 p -64.47 -30.41 71.44 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.5 -0.75 . . . . 0.0 112.835 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -79.43 -40.21 30.52 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 172.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -57.52 -40.49 78.88 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.151 0.887 . . . . 0.0 111.818 171.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.32 80.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 172.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -45.85 78.91 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.437 0.695 . . . . 0.0 111.935 172.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.78 -42.74 84.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.368 0.667 . . . . 0.0 111.512 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.99 -43.59 98.63 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.316 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.2 pt -72.47 -27.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 120.771 1.623 . . . . 0.0 113.585 175.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.5 -17.53 56.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.916 0.887 . . . . 0.0 113.164 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.26 -17.43 26.0 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.806 2.042 . . . . 0.0 112.02 166.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.89 29.97 21.91 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.023 1.297 . . . . 0.0 115.044 178.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.65 52.57 0.83 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.977 2.511 . . . . 0.0 109.628 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -58.92 -36.93 75.55 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 120.942 -1.099 . . . . 0.0 112.434 -170.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 m -62.05 -22.67 65.94 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.106 0.962 . . . . 0.0 113.405 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -81.29 -36.34 29.94 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.962 -1.086 . . . . 0.0 111.714 171.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.15 -38.5 78.83 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.8 pt -66.94 -30.84 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.706 0.802 . . . . 0.0 113.012 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -66.0 -49.72 66.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.292 0.637 . . . . 0.0 110.791 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 25.5 ttm -65.99 -31.01 71.67 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.8 m -71.74 -34.98 69.99 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.048 -1.033 . . . . 0.0 112.533 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -70.5 -33.34 71.1 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.086 -1.009 . . . . 0.0 112.346 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.75 -27.35 66.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.494 0.718 . . . . 0.0 112.189 168.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.01 -23.65 48.16 Favored Glycine 0 CA--C 1.538 1.525 0 O-C-N 120.302 -1.499 . . . . 0.0 114.778 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.84 -27.72 44.39 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.603 1.701 . . . . 0.0 112.511 166.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -64.33 -2.66 2.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 115.81 174.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -117.93 28.13 8.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.953 1.701 . . . . 0.0 112.121 -174.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.8 p -123.46 -9.77 7.98 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -161.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.5 p -76.28 32.7 0.12 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -147.42 144.78 28.9 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 127.856 2.462 . . . . 0.0 110.606 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.66 -21.53 64.49 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -61.72 -22.86 65.72 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.49 1.116 . . . . 0.0 113.128 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -129.37 22.03 5.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.678 1.591 . . . . 0.0 113.045 -171.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.28 -27.3 38.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 O-C-N 120.568 -1.332 . . . . 0.0 112.704 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.13 -29.4 34.79 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.842 -1.161 . . . . 0.0 112.014 172.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.0 mm -65.68 -32.63 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.932 1.293 . . . . 0.0 110.945 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -63.15 -37.97 89.31 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.179 -0.95 . . . . 0.0 112.975 177.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.7 m -67.66 -46.01 73.62 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.667 0.787 . . . . 0.0 112.286 166.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.69 -56.12 13.4 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.597 1.159 . . . . 0.0 111.704 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.4 -31.12 68.21 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.598 1.09 . . . . 0.0 113.462 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -71.1 -40.84 71.27 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.748 1.158 . . . . 0.0 112.433 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.28 67.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.38 0.991 . . . . 0.0 111.931 173.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.349 1.431 . . . . 0.0 112.217 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.5 tp -64.94 -37.86 89.06 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.776 0.83 . . . . 0.0 112.229 176.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.47 -46.89 58.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 15.8 tp -73.02 -19.52 61.18 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.619 -1.3 . . . . 0.0 112.596 -177.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.36 87.35 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 120.27 1.395 . . . . 0.0 112.489 168.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . 0.328 0.9 OUTLIER -78.79 -9.75 59.55 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 169.725 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -82.74 -43.76 7.58 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.23 1.395 . . . . 0.0 114.106 166.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.36 -28.99 65.55 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.075 1.75 . . . . 0.0 113.253 -177.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.12 -26.75 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 172.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 170.93 147.74 5.73 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 124.592 1.091 . . . . 0.0 112.062 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.3 m -71.0 -11.76 61.15 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.1 t -127.32 130.75 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 125.936 1.694 . . . . 0.0 108.434 162.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 7.64 1.43 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.6 mt -70.39 121.36 83.12 Favored Pre-proline 0 CA--C 1.548 0.896 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 155.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -75.46 -11.72 20.65 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.257 3.305 . . . . 0.0 114.778 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 t 58.26 48.0 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-O 122.895 1.331 . . . . 0.0 111.106 -172.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 18.7 m -130.26 166.84 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.876 1.67 . . . . 0.0 110.352 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -63.67 -55.49 23.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 30.9 m -145.89 -24.55 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.96 -34.73 78.64 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -157.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -140.46 38.3 1.87 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.102 1.319 . . . . 0.0 113.589 -172.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.6 mt -64.4 163.32 26.67 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.556 1.542 . . . . 0.0 113.391 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -66.27 157.86 57.87 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.764 2.309 . . . . 0.0 111.929 158.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -62.28 135.23 57.37 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.861 1.264 . . . . 0.0 113.321 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 73.74 1.75 59.32 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 125.855 1.693 . . . . 0.0 115.988 175.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -69.41 -49.05 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.027 1.331 . . . . 0.0 112.204 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -157.3 169.87 23.77 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-O 122.184 0.992 . . . . 0.0 113.297 167.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 8.5 ptp85 -123.45 149.55 44.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.414 2.286 . . . . 0.0 110.982 176.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.483 1.185 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -169.648 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 76.8 mtp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -72.27 158.23 36.24 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.511 1.05 . . . . 0.0 113.404 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -150.52 152.96 34.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.173 -0.955 . . . . 0.0 113.422 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 23.5 t -22.45 123.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 129.452 3.101 . . . . 0.0 113.69 164.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 0' ' ' ASP . . . . . 0.425 ' H ' ' ND2' ' A' ' 12' ' ' ASN . 38.7 t70 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.455 1.902 . . . . 0.0 111.273 170.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.0 p -58.54 -37.3 75.37 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.409 1.484 . . . . 0.0 114.677 -166.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -65.76 -34.98 79.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.111 0.965 . . . . 0.0 111.928 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -15.74 57.2 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 175.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -77.01 -48.33 18.23 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.894 -1.128 . . . . 0.0 111.355 166.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -35.6 81.02 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.547 -1.346 . . . . 0.0 112.527 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.41 -21.92 62.79 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -84.55 -38.04 20.48 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.782 1.174 . . . . 0.0 112.253 171.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.86 -32.34 73.82 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 111.736 176.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -56.49 -42.55 78.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.576 1.15 . . . . 0.0 112.107 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.69 -43.09 96.53 Favored Glycine 0 CA--C 1.533 1.216 0 O-C-N 121.587 -0.696 . . . . 0.0 113.252 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -64.5 -37.77 88.68 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.604 -0.939 . . . . 0.0 112.049 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.3 t -66.76 -45.56 78.18 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.654 -0.654 . . . . 0.0 111.877 173.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.33 -36.67 73.75 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 112.575 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.8 -40.73 80.6 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 170.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -38.76 91.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.938 0.895 . . . . 0.0 112.78 175.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 4.24 10.84 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 173.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.16 4.38 90.24 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 121.069 -1.019 . . . . 0.0 114.274 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.7 mt -88.95 55.44 3.35 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.863 1.665 . . . . 0.0 110.674 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -57.05 -39.68 75.33 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.958 0.903 . . . . 0.0 111.837 -175.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.94 -38.21 69.86 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.53 -0.731 . . . . 0.0 111.553 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.53 -40.3 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.252 1.021 . . . . 0.0 111.763 171.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.49 84.11 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.351 -0.843 . . . . 0.0 112.034 175.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -59.37 -35.9 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.743 1.217 . . . . 0.0 111.063 172.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -63.22 -45.55 91.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.438 1.095 . . . . 0.0 111.577 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.15 -43.94 93.65 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.54 1.136 . . . . 0.0 112.011 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 24.7 m-85 -65.86 -35.21 80.03 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 0.0 112.396 174.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -67.94 -25.69 65.59 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.536 -0.728 . . . . 0.0 112.613 173.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.9 mm-40 -66.26 -34.7 78.6 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.283 1.401 . . . . 0.0 111.813 171.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.12 -48.11 83.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 118.689 0.677 . . . . 0.0 110.609 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.8 mt -72.03 -41.41 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.503 1.121 . . . . 0.0 110.212 -177.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.6 m -57.62 -37.93 74.1 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.768 0.827 . . . . 0.0 111.626 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.42 -29.25 47.03 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -136.08 62.16 44.15 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.625 1.57 . . . . 0.0 112.374 -168.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -64.42 -23.85 64.66 Favored 'Trans proline' 0 C--N 1.352 0.725 0 N-CA-C 117.516 2.083 . . . . 0.0 117.516 -161.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -104.01 4.85 34.93 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.267 1.027 . . . . 0.0 113.097 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -84.74 116.25 64.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 120.941 -1.1 . . . . 0.0 110.842 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.457 ' HA ' ' CD2' ' A' ' 41' ' ' TYR . 71.6 Cg_endo -64.19 -13.06 35.7 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.498 2.132 . . . . 0.0 114.223 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -52.24 -42.49 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 124.353 1.061 . . . . 0.0 112.228 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.01 -39.83 62.97 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.683 -0.509 . . . . 0.0 112.272 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 38' ' ' PRO . 2.7 m-30 -59.62 -38.99 82.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 117.576 0.688 . . . . 0.0 110.46 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.4 p -63.89 -35.93 82.27 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -79.43 -29.85 42.05 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.55 -0.718 . . . . 0.0 112.528 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -69.76 -33.17 72.05 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.417 1.008 . . . . 0.0 112.084 168.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.49 91.29 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.714 -1.241 . . . . 0.0 112.36 167.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.6 ttt -60.98 -37.81 83.74 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.641 -0.662 . . . . 0.0 111.865 170.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.417 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.58 -46.59 88.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.885 0.766 . . . . 0.0 111.761 173.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.1 mt -63.18 -37.4 87.07 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.554 -0.716 . . . . 0.0 112.678 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 26.6 pt -76.36 -7.64 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 172.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.37 -18.24 14.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.62 1.568 . . . . 0.0 113.207 176.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 tt -86.25 -34.64 20.35 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.563 1.945 . . . . 0.0 110.484 166.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.28 20.11 9.43 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.809 1.195 . . . . 0.0 114.961 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -96.35 53.61 1.33 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.015 1.726 . . . . 0.0 109.828 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -57.05 -34.58 68.39 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.778 1.231 . . . . 0.0 113.273 -169.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -66.63 -23.79 66.21 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.654 1.182 . . . . 0.0 112.299 176.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -85.63 -34.93 21.25 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.408 -0.807 . . . . 0.0 111.102 168.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.37 97.21 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.378 -0.826 . . . . 0.0 112.479 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.3 pt -59.78 -40.4 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.654 0.661 . . . . 0.0 111.799 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -64.73 -44.93 88.58 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.99 1.316 . . . . 0.0 111.238 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.2 ttm -68.24 -32.67 73.02 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.452 -0.78 . . . . 0.0 112.776 177.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.7 m -69.55 -42.62 74.34 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 120.802 -1.186 . . . . 0.0 111.853 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -60.72 -41.36 95.13 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.441 0.696 . . . . 0.0 111.357 172.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.95 -29.32 69.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 171.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.28 -28.25 45.29 Favored Glycine 0 N--CA 1.474 1.178 0 CA-C-N 120.768 1.622 . . . . 0.0 114.524 174.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.09 -20.76 65.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 119.887 1.844 . . . . 0.0 112.81 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -57.44 -11.98 2.29 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.51 1.524 . . . . 0.0 114.687 165.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -116.09 32.22 6.24 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 126.998 2.119 . . . . 0.0 112.242 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.6 p -136.99 8.48 2.99 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -167.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.2 m -78.62 2.89 17.85 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.4 t -144.27 156.08 44.12 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.891 -1.131 . . . . 0.0 113.177 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.12 -28.0 16.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.171 2.188 . . . . 0.0 116.734 -166.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -75.45 -0.0 18.57 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -132.27 16.91 4.52 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.974 1.71 . . . . 0.0 113.545 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.58 -27.73 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 119.534 -1.979 . . . . 0.0 113.338 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.85 74.2 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.655 -0.653 . . . . 0.0 111.193 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.29 -34.42 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.08 0.952 . . . . 0.0 111.033 174.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -52.51 -59.61 4.23 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.084 0.856 . . . . 0.0 109.901 171.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.7 m -61.64 -39.59 91.86 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.902 1.281 . . . . 0.0 113.115 176.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -79.44 4.4 15.64 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -110.65 -29.29 8.08 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 117.177 -1.392 . . . . 0.0 113.287 152.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -53.86 -57.72 9.91 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 121.315 1.871 . . . . 0.0 111.203 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -31.92 73.01 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.786 -0.571 . . . . 0.0 111.457 -172.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -62.98 -43.57 98.42 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.823 0.849 . . . . 0.0 111.152 174.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -66.92 -42.62 85.07 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.649 1.179 . . . . 0.0 111.194 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.3 -33.98 74.46 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.735 1.214 . . . . 0.0 113.095 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 18.8 mt -93.56 -12.29 29.87 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -46.21 78.41 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.932 1.696 . . . . 0.0 110.298 164.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -74.09 -16.24 61.03 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -76.06 -47.73 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.034 1.778 . . . . 0.0 113.579 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.19 -31.58 66.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.869 1.667 . . . . 0.0 112.816 -176.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.77 -15.72 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -139.96 -131.63 2.8 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 125.742 1.639 . . . . 0.0 112.848 -169.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 19.1 m -107.09 136.26 47.25 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.344 1.058 . . . . 0.0 112.096 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.5 m -100.31 172.38 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 126.006 1.722 . . . . 0.0 112.53 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -73.77 -158.25 0.06 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.368 1.067 . . . . 0.0 112.031 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.1 mt 60.27 67.82 1.55 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.926 1.69 . . . . 0.0 109.573 -170.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.67 -15.7 24.17 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.075 2.517 . . . . 0.0 113.317 -175.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 t 61.15 22.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 114.15 1.166 . . . . 0.0 114.15 -176.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.1 m -140.08 158.86 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.227 2.211 . . . . 0.0 108.972 170.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.03 147.73 46.26 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . 0.268 1.9 p 51.22 1.37 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 130.255 3.422 . . . . 0.0 119.064 171.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -86.11 53.76 2.9 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 119.529 -1.982 . . . . 0.0 115.846 -166.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . 0.258 21.2 tt0 68.42 50.84 0.69 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.207 1.803 . . . . 0.0 110.265 -174.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -87.02 156.42 54.93 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 126.483 1.913 . . . . 0.0 112.189 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.55 157.6 35.99 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 122.615 2.21 . . . . 0.0 114.299 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.77 -28.51 61.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.119 1.368 . . . . 0.0 114.06 -177.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -107.75 9.92 37.82 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.205 1.383 . . . . 0.0 115.744 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -88.56 -36.15 16.51 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.93 1.865 . . . . 0.0 114.85 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -128.92 -1.85 5.26 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -125.74 167.22 15.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.062 1.745 . . . . 0.0 111.177 170.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 78.3 p . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 126.774 2.03 . . . . 0.0 114.438 -176.888 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.46 -26.63 13.79 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.025 1.284 . . . . 0.0 112.201 167.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 63.91 171.07 0.17 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.588 2.355 . . . . 0.0 115.338 174.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 9.3 p -160.92 163.08 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 127.007 2.123 . . . . 0.0 108.993 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.253 1.26 0 C-N-CA 127.594 2.357 . . . . 0.0 116.01 -175.395 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -65.44 -20.25 66.29 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.049 -1.032 . . . . 0.0 113.541 -172.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -63.42 -42.47 98.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.42 1.488 . . . . 0.0 111.372 171.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -15.13 61.88 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.638 -1.289 . . . . 0.0 113.788 176.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.86 -46.67 14.91 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.927 0.891 . . . . 0.0 110.666 165.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -37.3 83.34 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.418 -1.426 . . . . 0.0 112.676 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -73.65 -24.26 59.98 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.918 0.887 . . . . 0.0 113.13 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -83.89 -31.81 25.5 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.15 0.886 . . . . 0.0 113.191 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.46 -45.38 69.19 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.928 0.785 . . . . 0.0 111.183 169.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -50.97 -48.15 61.21 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.841 1.256 . . . . 0.0 110.537 168.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.54 50.32 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 117.805 -1.553 . . . . 0.0 114.792 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.418 HD22 ' HB ' ' B' ' -1' ' ' VAL . 37.3 t30 -90.23 -41.91 11.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 121.061 2.431 . . . . 0.0 111.575 173.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.4 t -57.43 -36.83 71.88 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.549 -0.719 . . . . 0.0 112.338 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.2 mt -62.54 -39.64 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.96 -1.088 . . . . 0.0 112.207 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.99 -40.3 96.06 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.876 1.216 . . . . 0.0 112.585 169.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.71 -42.5 83.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.348 0.522 . . . . 0.0 112.223 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -74.7 -36.37 62.72 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.267 1.427 . . . . 0.0 113.278 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.36 10.4 8.0 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.382 1.467 . . . . 0.0 115.577 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -89.89 58.63 4.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.312 2.245 . . . . 0.0 109.64 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -60.07 -37.02 78.66 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.709 1.204 . . . . 0.0 113.595 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.5 mmt-85 -73.65 -42.37 61.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.73 0.695 . . . . 0.0 110.624 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -65.15 -30.04 70.93 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.3 14.09 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.49 0.716 . . . . 0.0 111.308 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.81 -35.31 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.989 1.315 . . . . 0.0 111.907 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -54.62 -45.79 73.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.724 0.809 . . . . 0.0 112.397 170.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.4 m -63.99 -38.92 92.85 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.167 0.894 . . . . 0.0 112.21 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -67.42 -35.83 80.05 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -65.11 -29.05 69.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 118.689 0.677 . . . . 0.0 111.908 174.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -72.3 -26.36 61.94 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.509 1.049 . . . . 0.0 112.764 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.0 mt -62.69 -49.31 75.6 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.204 0.601 . . . . 0.0 110.593 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.3 mt -80.93 -27.6 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.694 1.198 . . . . 0.0 111.195 -173.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.4 m -62.25 -27.89 69.32 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.383 -1.448 . . . . 0.0 112.194 168.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.78 -27.29 16.56 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 171.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -135.83 76.11 54.03 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.067 1.747 . . . . 0.0 110.426 -171.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -61.73 -25.0 78.27 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.938 3.092 . . . . 0.0 118.203 -166.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -116.46 -22.26 8.83 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.673 1.189 . . . . 0.0 112.502 -175.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.02 122.75 65.22 Favored Pre-proline 0 CA--C 1.545 0.777 0 O-C-N 121.657 -0.652 . . . . 0.0 112.57 -168.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.74 -20.4 51.13 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.112 2.541 . . . . 0.0 113.963 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.32 -32.65 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 119.114 0.87 . . . . 0.0 113.291 170.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.14 -40.89 15.05 Favored Glycine 0 C--N 1.34 0.778 0 O-C-N 121.409 -0.807 . . . . 0.0 111.846 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -70.93 -32.67 69.65 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -174.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.0 p -68.41 -41.12 80.88 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.722 1.601 . . . . 0.0 111.753 172.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -70.69 -36.44 73.3 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.832 0.853 . . . . 0.0 111.817 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -74.27 -29.5 61.69 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.565 -1.334 . . . . 0.0 112.115 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.04 -33.08 73.9 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.699 -1.251 . . . . 0.0 112.316 165.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -65.72 -40.58 92.37 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.333 -0.855 . . . . 0.0 111.189 171.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.96 86.79 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.586 -0.696 . . . . 0.0 112.516 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.63 -40.47 87.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.488 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 31.4 pt -76.38 -25.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 120.632 1.56 . . . . 0.0 113.452 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.17 -15.88 59.34 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 119.496 1.044 . . . . 0.0 113.268 172.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -92.28 -34.05 14.39 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.791 1.636 . . . . 0.0 111.734 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.16 25.1 5.18 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.557 2.027 . . . . 0.0 115.982 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -99.0 56.6 1.05 Allowed 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 118.941 1.371 . . . . 0.0 111.938 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -57.44 -30.45 65.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.028 1.331 . . . . 0.0 113.663 -173.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.4 m -72.42 -30.73 64.88 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.178 0.899 . . . . 0.0 112.491 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -78.46 -30.72 47.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.144 0.884 . . . . 0.0 111.281 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.67 -40.84 92.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.98 0.912 . . . . 0.0 112.516 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.9 pt -70.67 -25.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.6 tm0? -72.41 -44.15 62.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.677 0.672 . . . . 0.0 111.165 166.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.4 ttm -58.61 -31.83 68.45 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.78 0.718 . . . . 0.0 112.19 174.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 94.0 m -60.9 -46.89 88.84 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.512 -0.743 . . . . 0.0 112.572 171.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -68.87 -35.98 77.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.254 1.021 . . . . 0.0 112.209 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.52 -27.22 69.01 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.764 0.826 . . . . 0.0 112.454 168.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.4 -27.15 52.85 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.285 -1.51 . . . . 0.0 114.139 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.07 -12.49 55.79 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.096 1.448 . . . . 0.0 112.863 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -71.37 -5.55 33.47 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.22 1.408 . . . . 0.0 114.716 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.54 29.46 5.74 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.467 1.507 . . . . 0.0 113.659 -167.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 70.3 p -117.77 -5.14 11.11 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 -161.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.89 30.57 0.5 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -155.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.8 p -144.32 163.85 32.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.009 1.324 . . . . 0.0 111.828 -176.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.15 -28.12 69.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.099 0.96 . . . . 0.0 113.192 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.16 -19.69 64.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.006 0.922 . . . . 0.0 112.809 172.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -127.66 12.51 6.87 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -171.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 p -64.62 -32.92 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 120.837 -1.164 . . . . 0.0 113.225 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.3 -37.32 52.94 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.273 -0.892 . . . . 0.0 110.645 170.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.17 -37.78 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.905 0.882 . . . . 0.0 112.681 171.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ttp85 -59.16 -40.99 87.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.91 0.884 . . . . 0.0 111.281 176.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.1 m -70.62 -39.44 73.72 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.966 0.906 . . . . 0.0 112.84 167.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -61.96 -29.65 70.39 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.202 1.365 . . . . 0.0 112.715 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.7 -38.28 19.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.717 1.144 . . . . 0.0 113.498 169.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -66.89 -40.75 87.86 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 120.362 1.437 . . . . 0.0 113.706 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -36.81 73.67 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.498 0.59 . . . . 0.0 111.05 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -61.84 -36.14 80.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.881 0.872 . . . . 0.0 111.674 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.9 tt -67.4 -51.21 54.56 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.372 1.469 . . . . 0.0 110.6 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.07 -36.14 74.56 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.506 1.122 . . . . 0.0 112.562 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.48 -7.06 59.4 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 173.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.31 39.19 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 120.876 1.671 . . . . 0.0 109.179 164.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -63.51 -29.0 70.34 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.713 . . . . 0.0 111.388 169.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.41 -43.87 60.59 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 125.784 1.659 . . . . 0.0 113.707 172.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -76.11 -23.07 54.9 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.1 p -87.95 -15.4 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.431 0.692 . . . . 0.0 112.839 167.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.89 -162.74 26.04 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.821 1.677 . . . . 0.0 114.223 177.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 28.6 m -128.15 113.85 16.25 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.379 1.072 . . . . 0.0 112.837 -174.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.5 p -99.47 153.62 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 125.247 1.419 . . . . 0.0 110.715 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.72 110.5 21.55 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.352 1.461 . . . . 0.0 111.09 -178.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 48.4 mt -126.77 84.47 62.92 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.996 0.919 . . . . 0.0 109.317 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -80.69 0.5 9.98 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.743 2.962 . . . . 0.0 114.762 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 59.05 27.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 115.378 1.621 . . . . 0.0 115.378 171.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 23.3 m -145.01 155.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 126.378 1.871 . . . . 0.0 109.453 177.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 50.34 -154.87 0.12 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.41 1.484 . . . . 0.0 114.659 -177.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.01 20.01 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 128.836 2.855 . . . . 0.0 111.621 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -112.34 -46.24 3.2 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.727 -1.233 . . . . 0.0 112.944 -157.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -120.25 16.67 12.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.405 1.882 . . . . 0.0 113.867 -173.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 76.4 mt -72.67 173.9 5.15 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 128.048 2.539 . . . . 0.0 111.793 160.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -63.59 -175.89 0.29 Allowed 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 122.73 2.286 . . . . 0.0 111.693 154.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.79 118.72 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.557 -1.34 . . . . 0.0 111.647 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.47 -111.06 3.85 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 125.155 1.359 . . . . 0.0 112.765 -173.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 18.7 t80 58.08 -27.8 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.773 2.829 . . . . 0.0 118.466 -176.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -43.05 110.45 0.19 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 121.911 2.141 . . . . 0.0 112.894 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -76.65 13.52 0.98 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 126.554 1.942 . . . . 0.0 113.809 -169.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.93 2.092 . . . . 0.0 113.454 -171.583 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 19.8 ptm . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 120.445 0.165 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -150.19 162.54 40.26 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.607 1.163 . . . . 0.0 112.132 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -106.1 -102.5 0.34 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.59 1.156 . . . . 0.0 109.513 172.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -1' ' ' VAL . . . . . 0.418 ' HB ' HD22 ' A' ' 12' ' ' ASN . 14.6 m -136.67 166.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.794 1.638 . . . . 0.0 112.82 -169.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 127.304 2.242 . . . . 0.0 115.221 -173.18 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.3 p -67.15 -31.6 72.15 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -163.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -67.23 -46.08 74.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.853 0.751 . . . . 0.0 112.063 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.293 0.0 OUTLIER -71.22 -26.9 63.13 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.525 -1.36 . . . . 0.0 111.782 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -70.77 -13.73 62.16 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.04 -35.61 10.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.488 1.04 . . . . 0.0 112.878 166.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -70.77 -36.73 73.2 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.264 0.938 . . . . 0.0 113.116 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.66 -21.54 66.44 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.909 -1.12 . . . . 0.0 112.804 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -90.52 -34.74 15.43 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.089 1.356 . . . . 0.0 112.481 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -56.08 -41.15 74.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.845 1.258 . . . . 0.0 111.811 174.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.14 -42.3 71.83 Favored Glycine 0 CA--C 1.54 1.608 0 O-C-N 121.442 -0.786 . . . . 0.0 113.546 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -68.57 -40.22 80.66 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.952 1.376 . . . . 0.0 111.289 175.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.6 m -58.74 -36.55 74.49 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.425 -0.797 . . . . 0.0 112.714 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.35 -34.04 76.48 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.88 -1.138 . . . . 0.0 111.809 173.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -70.49 -26.64 63.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -51.12 60.71 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.368 1.44 . . . . 0.0 110.343 166.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -66.55 -33.64 76.12 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -175.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.32 -0.4 8.83 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.956 1.142 . . . . 0.0 115.956 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.2 mt -89.54 53.16 2.52 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.233 2.213 . . . . 0.0 111.342 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -56.08 -36.89 68.63 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.892 1.677 . . . . 0.0 112.971 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -83.27 -28.52 29.08 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.03 -1.044 . . . . 0.0 112.982 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -73.43 -29.0 62.28 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 118.722 0.692 . . . . 0.0 112.118 166.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.21 69.05 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 172.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.6 t -60.24 -37.19 72.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 O-C-N 121.15 -0.969 . . . . 0.0 111.065 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -62.57 -45.75 91.48 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.66 -0.686 . . . . 0.0 112.237 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.5 t -55.19 -47.92 74.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.366 1.067 . . . . 0.0 111.481 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -68.67 -29.95 68.53 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -68.72 -23.47 64.36 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.224 -0.923 . . . . 0.0 112.78 168.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -69.63 -34.84 74.62 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.755 1.161 . . . . 0.0 111.242 172.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.47 -48.55 77.21 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.901 0.773 . . . . 0.0 109.915 174.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.8 mt -63.14 -37.95 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.952 0.501 . . . . 0.0 110.789 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.6 m -58.46 -39.5 80.09 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.47 -0.769 . . . . 0.0 112.027 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.25 -31.0 43.4 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.43 74.49 20.05 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 124.572 1.149 . . . . 0.0 112.859 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -63.35 -28.56 71.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.641 2.894 . . . . 0.0 117.436 -168.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -105.62 4.84 30.67 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.027 1.331 . . . . 0.0 112.957 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.51 120.55 73.18 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.342 -0.849 . . . . 0.0 110.103 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -61.93 -14.59 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 122.318 2.012 . . . . 0.0 114.226 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.4 p -47.14 -50.56 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.155 0.982 . . . . 0.0 111.416 167.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.11 -43.45 93.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 123.924 0.773 . . . . 0.0 112.5 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -63.53 -40.83 98.05 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.356 0.662 . . . . 0.0 112.169 173.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.0 p -67.43 -35.29 78.95 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.34 -0.85 . . . . 0.0 112.761 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -72.25 -38.51 68.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.144 0.978 . . . . 0.0 112.352 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -71.18 -32.26 68.65 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.411 1.005 . . . . 0.0 112.479 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.38 -42.09 96.35 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.114 -0.991 . . . . 0.0 112.322 168.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.0 -42.59 94.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.845 0.858 . . . . 0.0 111.511 171.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.97 90.78 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.706 0.802 . . . . 0.0 112.414 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 48.9 mt -64.51 -34.92 79.35 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.61 -0.681 . . . . 0.0 112.812 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.8 pt -73.62 -35.78 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.73 1.15 . . . . 0.0 112.892 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -12.83 61.36 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.44 1.096 . . . . 0.0 113.159 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.8 tt -93.44 -41.19 9.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.566 1.947 . . . . 0.0 111.528 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 110.63 21.85 6.63 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 124.772 1.177 . . . . 0.0 115.064 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -100.87 51.48 0.86 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.564 1.546 . . . . 0.0 109.67 171.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -51.02 -41.7 59.98 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.6 1.96 . . . . 0.0 112.624 -176.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.1 m -63.72 -25.95 68.43 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 113.158 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -81.19 -35.9 30.8 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.179 -0.951 . . . . 0.0 111.233 171.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -39.41 91.77 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.803 0.841 . . . . 0.0 112.195 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.3 pt -64.32 -34.76 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.762 0.71 . . . . 0.0 112.474 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.5 tm0? -64.47 -47.91 77.22 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.811 0.732 . . . . 0.0 110.551 171.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.5 ttm -63.18 -31.34 72.46 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 178.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.8 m -66.83 -46.18 75.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.971 -1.08 . . . . 0.0 112.362 173.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -72.41 -32.7 66.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.622 0.769 . . . . 0.0 111.867 -178.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -39.0 92.87 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.953 1.301 . . . . 0.0 112.382 164.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.18 -28.19 73.02 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 120.196 -1.565 . . . . 0.0 113.969 177.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.71 -23.1 67.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.454 1.127 . . . . 0.0 112.857 168.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -74.2 -0.18 15.99 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 169.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.22 20.71 15.98 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.597 1.559 . . . . 0.0 113.103 175.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -139.11 126.72 21.84 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.355 -1.466 . . . . 0.0 114.036 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -148.67 -36.02 0.19 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.073 1.749 . . . . 0.0 112.429 167.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.9 p -76.65 167.37 21.96 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.317 1.447 . . . . 0.0 113.622 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.86 -21.03 66.03 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.9 -1.125 . . . . 0.0 113.148 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.37 -28.45 66.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.401 1.08 . . . . 0.0 112.756 170.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -120.87 15.72 11.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.228 1.411 . . . . 0.0 112.369 -169.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.79 -37.24 61.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.247 -0.908 . . . . 0.0 112.259 -178.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.51 -36.41 63.2 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.688 -0.633 . . . . 0.0 110.623 172.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.8 mm -53.08 -39.98 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.397 1.079 . . . . 0.0 112.447 168.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -34.3 76.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.246 1.019 . . . . 0.0 112.257 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.9 m -80.21 -33.33 38.21 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.112 0.965 . . . . 0.0 113.489 166.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -71.94 -3.07 20.51 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.341 1.456 . . . . 0.0 114.382 176.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -96.84 -47.64 5.77 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.182 0.901 . . . . 0.0 112.205 153.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.13 -32.09 69.93 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -171.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.43 -37.99 74.49 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.177 1.353 . . . . 0.0 111.019 173.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.358 4.5 ptp180 -80.41 -12.86 59.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.84 -44.14 67.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.452 1.101 . . . . 0.0 111.168 157.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -35.98 78.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.981 1.312 . . . . 0.0 112.815 171.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.93 -23.83 28.66 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.89 1.276 . . . . 0.0 113.826 176.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.7 75.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.349 1.431 . . . . 0.0 109.715 168.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -59.45 -26.31 65.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.733 1.213 . . . . 0.0 112.01 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.38 -58.7 7.55 Favored Glycine 0 N--CA 1.467 0.732 0 C-N-CA 127.351 2.405 . . . . 0.0 113.622 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.71 -31.73 68.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.1 0.96 . . . . 0.0 112.471 -174.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 2.2 p -83.8 -16.13 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -113.6 178.16 18.32 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 116.253 1.261 . . . . 0.0 116.253 -167.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -103.55 -30.6 10.4 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.826 2.05 . . . . 0.0 112.679 172.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.4 m -153.97 149.82 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 126.507 1.923 . . . . 0.0 112.576 174.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -90.49 143.6 26.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.433 1.093 . . . . 0.0 109.898 156.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.0 mt 57.78 79.22 0.33 Allowed Pre-proline 0 N--CA 1.478 0.97 0 C-N-CA 125.153 1.381 . . . . 0.0 110.526 -174.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -75.34 -6.02 17.33 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.294 1.996 . . . . 0.0 114.734 -174.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 18.6 t 51.84 80.58 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 126.497 1.919 . . . . 0.0 112.366 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 28.4 m -135.64 28.29 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.16 1.384 . . . . 0.0 112.937 -170.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . 0.292 7.8 mm-40 60.32 -92.84 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.851 1.66 . . . . 0.0 110.851 -158.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 94.2 t -140.36 123.27 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 125.189 1.396 . . . . 0.0 110.041 175.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -166.43 -61.47 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.021 1.328 . . . . 0.0 112.992 174.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -143.8 61.64 1.37 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.916 1.286 . . . . 0.0 112.004 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 mt -103.7 149.58 37.26 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.991 1.717 . . . . 0.0 110.861 175.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.24 125.95 14.29 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.511 2.141 . . . . 0.0 113.029 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 48.3 28.5 1.63 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.545 2.338 . . . . 0.0 114.961 -175.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.07 36.79 20.59 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.91 -1.119 . . . . 0.0 114.77 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -64.4 152.25 41.95 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.006 1.322 . . . . 0.0 113.136 172.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.27 177.81 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 127.547 2.339 . . . . 0.0 116.381 -175.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.31 172.22 13.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.991 2.117 . . . . 0.0 113.017 -171.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 88.7 p . . . . . 0 C--O 1.257 1.462 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -179.557 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 11.4 ttt . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 118.65 -0.691 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -146.28 -4.68 0.6 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 175.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 58.6 48.88 11.16 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.305 1.442 . . . . 0.0 114.563 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 8.7 p -96.89 146.46 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.408 1.483 . . . . 0.0 112.301 178.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 37.5 t70 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.189 1.396 . . . . 0.0 114.628 -178.821 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.3 tpp . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.302 0.572 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.0 m -56.74 -33.09 66.2 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -170.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -72.32 -29.1 63.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 120.782 1.628 . . . . 0.0 112.844 177.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -24.42 60.98 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.805 -1.185 . . . . 0.0 113.118 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.98 -24.31 30.66 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.998 0.919 . . . . 0.0 111.841 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.2 tttt -70.05 -51.2 33.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.081 1.752 . . . . 0.0 111.674 162.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -25.19 66.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -166.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.72 -40.0 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 172.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -71.19 -30.3 66.23 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.394 0.678 . . . . 0.0 111.655 175.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -68.1 -43.58 78.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.494 1.518 . . . . 0.0 111.05 170.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.36 -53.42 43.28 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.269 0.938 . . . . 0.0 112.679 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -56.37 -48.8 76.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.714 1.257 . . . . 0.0 111.659 174.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.7 t -55.92 -47.45 77.49 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.768 0.827 . . . . 0.0 113.153 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.4 mt -61.28 -28.56 69.27 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.278 -0.889 . . . . 0.0 112.815 -177.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -67.93 -37.49 81.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.282 0.946 . . . . 0.0 113.21 170.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -36.41 81.1 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 119.906 1.23 . . . . 0.0 112.648 172.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -74.5 -6.18 46.94 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 171.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.83 11.5 84.56 Favored Glycine 0 CA--C 1.537 1.462 0 O-C-N 120.37 -1.456 . . . . 0.0 114.992 -178.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 48.5 mt -87.32 54.33 3.11 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.844 2.058 . . . . 0.0 110.613 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -55.88 -36.19 67.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.359 1.063 . . . . 0.0 112.638 -170.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -80.56 -18.47 48.25 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.775 1.23 . . . . 0.0 113.01 -176.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.01 -36.41 17.04 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.063 0.545 . . . . 0.0 111.442 165.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.751 1.22 . . . . 0.0 112.733 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.51 -36.72 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.794 0.838 . . . . 0.0 110.389 172.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -64.85 -43.14 93.99 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.441 1.018 . . . . 0.0 112.872 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.67 -39.39 91.24 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.821 0.737 . . . . 0.0 112.263 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.464 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 32.8 m-85 -75.31 -35.53 61.23 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 175.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -62.38 -36.02 81.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.336 0.971 . . . . 0.0 111.414 171.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -74.71 -15.9 60.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 113.271 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.65 -47.37 84.68 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.304 0.956 . . . . 0.0 110.682 160.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.1 mt -81.79 -25.94 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.337 1.055 . . . . 0.0 112.053 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 m -62.9 -33.15 74.71 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.572 -1.33 . . . . 0.0 111.183 169.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.83 -37.07 18.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.607 1.163 . . . . 0.0 113.404 174.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -129.86 74.14 80.87 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 125.86 1.664 . . . . 0.0 110.603 -169.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -63.13 -19.44 68.8 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.723 2.949 . . . . 0.0 117.537 -167.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -124.3 -10.73 7.5 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.443 1.097 . . . . 0.0 113.107 -171.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -70.13 122.87 87.56 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 124.014 0.926 . . . . 0.0 111.258 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HB2' HG21 ' A' ' 76' ' ' ILE . 85.4 Cg_endo -67.95 -9.23 24.99 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.999 1.8 . . . . 0.0 113.999 179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -46.38 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.605 1.093 . . . . 0.0 110.989 163.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.52 -39.88 95.84 Favored Glycine 0 CA--C 1.527 0.802 0 O-C-N 121.266 -0.896 . . . . 0.0 112.03 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -65.36 -38.86 91.35 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 117.77 0.785 . . . . 0.0 112.128 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 m -62.44 -38.28 89.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.211 1.005 . . . . 0.0 112.041 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -75.14 -40.78 59.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.534 1.133 . . . . 0.0 112.224 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -65.12 -31.79 73.16 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 120.292 -1.505 . . . . 0.0 112.244 173.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.31 -36.53 83.98 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.259 -0.9 . . . . 0.0 112.561 169.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.4 tpp -63.58 -44.11 95.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.099 0.863 . . . . 0.0 111.276 171.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.464 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -57.09 -48.29 78.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.264 0.626 . . . . 0.0 112.08 175.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.59 -39.2 93.3 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.537 -0.727 . . . . 0.0 112.445 -177.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.52 -7.69 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 CA-C-N 120.07 1.305 . . . . 0.0 114.134 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.36 -20.1 14.72 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.053 1.341 . . . . 0.0 113.555 176.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.24 -9.7 49.73 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.411 2.284 . . . . 0.0 111.422 166.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.67 21.48 63.85 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.915 1.245 . . . . 0.0 114.866 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -92.59 51.2 1.7 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.561 1.944 . . . . 0.0 109.402 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -58.15 -37.17 74.14 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.081 -1.012 . . . . 0.0 112.445 -170.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.7 m -52.7 -31.81 39.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.899 1.28 . . . . 0.0 113.484 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -95.84 -27.09 15.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.353 1.461 . . . . 0.0 110.858 -177.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.21 -41.98 80.52 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.933 0.893 . . . . 0.0 112.078 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.5 pt -65.43 -35.01 74.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 118.999 0.818 . . . . 0.0 111.588 177.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -63.26 -45.54 91.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.013 0.925 . . . . 0.0 111.337 170.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 35.2 tpp -60.46 -43.76 96.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.955 0.798 . . . . 0.0 112.299 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.91 -46.61 84.04 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.128 -0.982 . . . . 0.0 112.246 177.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.75 -36.47 83.16 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.857 0.863 . . . . 0.0 112.181 174.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -38.48 84.73 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.176 0.99 . . . . 0.0 111.788 172.513 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.94 -34.17 65.44 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 120.269 -1.519 . . . . 0.0 113.598 178.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.78 -6.53 27.23 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 118.524 1.162 . . . . 0.0 113.401 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -76.48 -22.56 54.38 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 162.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -92.55 -7.31 47.57 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.862 1.265 . . . . 0.0 114.31 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.0 p -86.54 -1.13 57.37 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 -160.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 m -86.71 42.2 1.0 Allowed 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 120.206 1.366 . . . . 0.0 114.236 -169.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 p -138.62 159.65 41.57 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.198 1.399 . . . . 0.0 111.544 169.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.76 -6.97 17.99 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -87.18 -14.98 39.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.678 1.591 . . . . 0.0 112.259 171.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -126.36 14.51 7.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.455 1.502 . . . . 0.0 114.014 -173.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.19 -14.93 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 120.549 -1.344 . . . . 0.0 114.219 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.95 -39.19 15.95 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.914 -1.116 . . . . 0.0 111.267 164.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.409 HG21 ' HB2' ' A' ' 38' ' ' PRO . 47.6 mm -53.06 -36.48 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.132 0.973 . . . . 0.0 111.371 170.536 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.3 ttp180 -55.36 -39.5 70.14 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.831 1.252 . . . . 0.0 113.269 175.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.2 m -78.06 -37.9 45.65 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.036 1.335 . . . . 0.0 112.856 170.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.6 mttm -55.37 -51.72 65.88 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.943 1.247 . . . . 0.0 111.381 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.92 -31.19 64.47 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.092 1.315 . . . . 0.0 113.456 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -77.34 -30.72 54.09 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 120.971 1.714 . . . . 0.0 114.568 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -42.2 59.64 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.29 1.405 . . . . 0.0 110.655 166.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -62.16 -32.57 73.21 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.172 0.896 . . . . 0.0 111.688 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.5 tp -67.76 -44.28 77.87 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.756 1.222 . . . . 0.0 112.815 171.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -68.96 -32.46 72.06 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.282 -0.886 . . . . 0.0 113.352 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.6 tp -83.2 -22.12 33.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.46 -0.781 . . . . 0.0 112.678 174.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.92 92.39 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.522 1.51 . . . . 0.0 111.089 164.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -63.58 -30.04 71.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.033 0.933 . . . . 0.0 111.989 172.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.32 -49.57 44.68 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 125.697 1.617 . . . . 0.0 112.538 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.63 -37.55 70.86 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.738 1.215 . . . . 0.0 112.162 -177.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p -70.08 -34.3 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 121.42 -0.8 . . . . 0.0 111.655 174.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -89.41 8.68 79.31 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.215 1.864 . . . . 0.0 115.64 177.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.0 m -77.68 171.24 15.24 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.593 1.157 . . . . 0.0 111.547 173.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.25 18.1 m 53.37 16.55 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 128.191 2.596 . . . . 0.0 117.988 167.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 56.29 178.63 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.9 mt 64.0 77.59 0.3 Allowed Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 111.459 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -85.03 -5.37 9.62 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.574 2.85 . . . . 0.0 113.614 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 t 55.13 68.8 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.12 2.168 . . . . 0.0 113.062 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.48 35.0 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 127.318 2.247 . . . . 0.0 112.045 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 58.8 -59.65 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.372 3.069 . . . . 0.0 115.376 -166.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 27.7 m -143.02 -20.28 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -167.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -95.05 -18.6 20.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.472 2.027 . . . . 0.0 116.472 -154.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -144.17 115.52 8.03 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.231 1.812 . . . . 0.0 108.071 172.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.9 mt -159.25 155.28 23.51 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 124.912 1.285 . . . . 0.0 111.558 -173.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -67.05 157.77 60.11 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.024 1.816 . . . . 0.0 111.533 163.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.86 140.3 56.54 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -172.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.22 -1.93 73.25 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.057 1.313 . . . . 0.0 115.888 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -71.77 -51.19 23.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.362 1.581 . . . . 0.0 112.616 -176.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -156.13 -54.96 0.09 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.729 1.212 . . . . 0.0 111.997 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -156.62 -179.11 7.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 126.395 1.878 . . . . 0.0 111.753 -172.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.617 1.967 . . . . 0.0 112.411 -166.422 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 47.9 mtt . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -126.64 -64.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.438 1.017 . . . . 0.0 111.83 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 46.93 88.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.162 2.185 . . . . 0.0 112.999 -172.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . 0.3 9.9 p -80.74 52.94 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.866 1.266 . . . . 0.0 113.963 -169.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . 0.265 35.4 m-20 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 129.688 3.195 . . . . 0.0 116.628 168.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.3 mmt . . . . . 0 N--CA 1.477 0.907 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 m -72.67 -29.29 63.29 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -155.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.76 -25.19 62.8 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.492 -1.38 . . . . 0.0 113.144 -176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -35.07 78.6 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.546 1.138 . . . . 0.0 112.332 170.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.525 ' HB2' ' HA ' ' B' ' -4' ' ' MET 0.257 0.2 OUTLIER -90.35 -14.43 33.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.92 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -27.97 32.94 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.667 1.187 . . . . 0.0 112.495 164.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -62.83 -50.68 70.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.958 1.303 . . . . 0.0 113.072 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -59.54 -30.48 68.63 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -49.59 49.5 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.727 -0.608 . . . . 0.0 110.912 171.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -58.72 -37.11 75.44 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.764 0.826 . . . . 0.0 111.56 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.89 -15.01 54.77 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.885 1.231 . . . . 0.0 115.176 174.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -94.84 -45.82 7.14 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.63 1.715 . . . . 0.0 110.754 168.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.3 m -53.41 -44.61 68.86 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.62 0.768 . . . . 0.0 112.755 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 mt -58.91 -38.11 78.18 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.246 1.018 . . . . 0.0 112.825 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -61.5 -38.16 86.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.283 -0.886 . . . . 0.0 112.05 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -71.17 -10.32 59.56 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -102.48 -0.79 31.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.018 1.327 . . . . 0.0 113.868 165.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.22 5.34 82.95 Favored Glycine 0 CA--C 1.536 1.365 0 O-C-N 121.116 -0.99 . . . . 0.0 115.001 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 98.3 mt -83.73 52.74 2.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.746 1.618 . . . . 0.0 110.952 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -56.87 -40.43 76.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.926 1.29 . . . . 0.0 111.924 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -72.96 -39.25 66.34 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.728 -0.653 . . . . 0.0 111.608 -178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -70.26 -32.65 70.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.445 1.02 . . . . 0.0 111.373 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.95 -44.3 89.87 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.015 -1.053 . . . . 0.0 112.183 173.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.97 -42.16 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.656 0.783 . . . . 0.0 110.924 171.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -58.53 -45.55 88.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.05 0.841 . . . . 0.0 112.516 174.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.2 m -62.72 -41.84 99.36 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.538 1.135 . . . . 0.0 112.5 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -67.48 -36.35 80.95 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.462 -0.774 . . . . 0.0 112.244 172.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.37 -28.52 69.75 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.722 0.692 . . . . 0.0 112.576 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -68.99 -28.81 66.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.89 -1.131 . . . . 0.0 112.229 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -63.5 -48.09 79.02 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.772 0.715 . . . . 0.0 110.373 169.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.6 mt -72.11 -24.72 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 C-N-CA 124.845 1.258 . . . . 0.0 111.241 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 94.5 m -68.32 -31.28 70.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.754 1.222 . . . . 0.0 111.455 172.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -85.41 -32.84 22.14 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.985 0.811 . . . . 0.0 112.803 169.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -132.21 77.71 70.29 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.18 1.392 . . . . 0.0 112.672 -169.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -65.98 -18.32 56.91 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 121.87 1.713 . . . . 0.0 115.088 175.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -113.3 -26.72 8.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.042 1.337 . . . . 0.0 112.896 -170.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -70.46 127.44 92.06 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.193 1.361 . . . . 0.0 111.486 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -67.9 -7.63 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.725 2.284 . . . . 0.0 115.277 -176.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 p -55.48 -39.61 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.808 1.243 . . . . 0.0 111.687 171.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.9 -45.56 32.85 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.365 -0.834 . . . . 0.0 112.115 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -64.75 -40.38 95.21 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.744 -0.857 . . . . 0.0 112.388 177.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 72.1 p -69.89 -18.52 63.41 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -83.9 -40.42 18.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 112.078 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.51 -37.69 73.4 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.64 -1.287 . . . . 0.0 112.018 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.98 -29.6 70.94 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 171.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.45 -42.68 87.28 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.042 0.837 . . . . 0.0 111.059 173.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.8 -46.42 87.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.966 0.506 . . . . 0.0 111.602 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 99.3 mt -59.27 -42.31 90.9 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.873 -0.517 . . . . 0.0 112.367 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.6 pt -73.73 -29.46 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.131 0.878 . . . . 0.0 113.339 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.56 -14.16 57.18 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.962 1.256 . . . . 0.0 114.095 175.513 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.5 tt -87.95 -23.16 23.95 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.39 1.876 . . . . 0.0 111.497 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.75 21.67 33.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.44 1.019 . . . . 0.0 114.463 -177.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -100.58 53.19 0.87 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.039 1.4 . . . . 0.0 110.734 173.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -52.36 -37.92 57.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.774 1.63 . . . . 0.0 112.378 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m -68.59 -15.44 63.53 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.042 1.737 . . . . 0.0 113.376 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -90.53 -33.66 15.84 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.37 -0.831 . . . . 0.0 111.588 165.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.6 -35.15 79.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 113.13 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 pt -62.74 -36.39 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.229 0.922 . . . . 0.0 112.985 177.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -67.06 -41.98 85.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.211 0.605 . . . . 0.0 111.605 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 ttm -76.38 -29.52 57.17 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.79 -39.34 73.2 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.019 -1.051 . . . . 0.0 111.207 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -59.79 -44.03 94.14 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.107 0.867 . . . . 0.0 111.536 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.43 -35.29 71.88 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 175.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.41 -27.18 52.73 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-N 120.265 1.393 . . . . 0.0 114.415 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -59.7 -32.74 70.8 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.266 2.033 . . . . 0.0 112.171 172.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -60.9 -17.61 51.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -85.51 -1.22 56.85 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.595 1.158 . . . . 0.0 112.942 175.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.7 p -106.0 22.06 16.27 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -162.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m -66.18 -32.79 74.44 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 p -104.8 166.65 10.24 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -174.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.87 -23.29 67.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.62 -22.83 64.2 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.828 -1.17 . . . . 0.0 112.656 174.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -124.17 17.46 9.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.21 1.804 . . . . 0.0 112.273 -169.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.09 -27.5 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.567 -1.333 . . . . 0.0 112.919 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.97 63.81 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.284 -0.885 . . . . 0.0 111.038 171.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.8 mm -58.83 -30.72 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.165 0.986 . . . . 0.0 111.261 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -64.94 -38.26 90.39 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.939 -1.1 . . . . 0.0 113.013 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.5 t -68.37 -43.29 77.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.302 1.441 . . . . 0.0 111.529 167.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.3 tppt? -54.21 -53.44 53.53 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.94 0.896 . . . . 0.0 111.814 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -74.23 -31.1 62.46 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 120.098 1.317 . . . . 0.0 114.011 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -75.28 -36.03 61.24 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.743 1.611 . . . . 0.0 113.433 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 -38.58 82.24 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.805 1.639 . . . . 0.0 110.828 172.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -56.06 -37.44 69.28 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 119.494 1.043 . . . . 0.0 111.627 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.8 tp -72.78 -42.83 63.53 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.263 1.025 . . . . 0.0 112.904 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -67.38 -23.66 65.61 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 175.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -97.77 -20.16 17.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.035 1.334 . . . . 0.0 114.211 174.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.27 -49.42 77.92 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.61 1.55 . . . . 0.0 109.498 163.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -64.44 -26.97 68.68 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.427 1.091 . . . . 0.0 112.484 171.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -80.81 -33.94 28.91 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.45 1.024 . . . . 0.0 115.406 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -93.88 -26.01 17.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.014 1.326 . . . . 0.0 112.926 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.2 p -67.8 -35.43 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.259 0.936 . . . . 0.0 111.75 170.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 155.46 100.96 0.18 Allowed Glycine 0 C--N 1.341 0.834 0 C-N-CA 124.497 1.046 . . . . 0.0 111.434 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 36.2 m -63.55 139.72 58.8 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.79 1.236 . . . . 0.0 113.207 -172.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 35.1 m -125.21 3.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 125.824 1.649 . . . . 0.0 112.839 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -123.58 168.0 13.19 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.838 1.655 . . . . 0.0 112.739 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.0 mt 55.19 63.02 7.11 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 126.85 2.06 . . . . 0.0 111.206 -174.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -80.72 -17.23 9.91 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.8 2.334 . . . . 0.0 113.07 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.4 t 52.56 58.85 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.838 1.655 . . . . 0.0 113.191 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.2 m -141.37 -158.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 126.874 2.07 . . . . 0.0 110.512 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -73.55 163.97 27.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 122.489 1.138 . . . . 0.0 112.679 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.37 139.62 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -166.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -151.47 -54.62 0.14 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.594 1.958 . . . . 0.0 109.796 170.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -141.06 -62.31 0.48 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.89 1.676 . . . . 0.0 111.476 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.8 mp 60.41 170.26 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 C-N-CA 126.959 2.104 . . . . 0.0 114.961 168.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.3 157.52 35.17 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.851 2.367 . . . . 0.0 111.977 172.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.71 131.12 49.69 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.558 0.694 . . . . 0.0 112.483 -170.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.71 61.68 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.957 1.265 . . . . 0.0 115.706 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -63.3 -51.19 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.216 2.008 . . . . 0.0 112.18 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -158.05 153.03 25.31 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.596 1.558 . . . . 0.0 110.28 169.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 28.6 mmt85 -126.24 139.88 52.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.21 1.004 . . . . 0.0 112.153 176.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.25 1.128 0 C-N-CA 127.879 2.471 . . . . 0.0 112.631 168.077 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' -4' ' ' MET . . . . . 0.525 ' HA ' ' HB2' ' A' ' 5' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -108.49 161.42 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -160.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -98.58 143.45 28.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.676 0.791 . . . . 0.0 111.437 168.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 30.2 t -121.85 104.68 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.019 1.328 . . . . 0.0 108.662 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 117.162 -1.399 . . . . 0.0 114.741 -162.803 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.3 m -57.42 -34.31 68.8 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -170.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -75.03 -20.89 59.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.43 1.014 . . . . 0.0 112.875 175.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.59 -17.9 55.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.596 -1.315 . . . . 0.0 113.18 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -74.16 -46.04 44.84 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.965 -1.084 . . . . 0.0 109.632 162.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -43.1 80.65 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.596 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.48 -24.38 61.17 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 120.223 1.374 . . . . 0.0 113.689 -178.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.264 10.9 ptpp? -77.85 -39.03 44.77 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 119.431 1.014 . . . . 0.0 112.71 169.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.14 -40.7 94.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.192 0.997 . . . . 0.0 112.277 170.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -60.85 -49.14 78.69 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.056 1.742 . . . . 0.0 111.34 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -39.36 97.14 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 119.409 1.004 . . . . 0.0 113.134 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -61.03 -42.3 98.22 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.626 1.713 . . . . 0.0 111.948 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.3 m -61.1 -44.4 97.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.218 1.007 . . . . 0.0 111.415 174.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.7 -38.92 92.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.747 1.219 . . . . 0.0 112.093 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -59.66 -35.68 74.9 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.599 1.091 . . . . 0.0 112.435 170.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -19.88 64.96 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 174.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -100.79 3.7 42.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.313 1.045 . . . . 0.0 113.239 170.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.92 13.47 83.36 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 121.122 -0.986 . . . . 0.0 114.768 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.6 mt -87.71 56.32 3.86 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.202 1.801 . . . . 0.0 110.344 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -57.33 -39.56 76.12 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.486 1.114 . . . . 0.0 113.246 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.02 -39.35 75.85 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.95 0.795 . . . . 0.0 110.751 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -64.63 -43.6 93.17 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.407 0.683 . . . . 0.0 111.045 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.31 76.81 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.876 0.871 . . . . 0.0 112.714 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.62 -38.48 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.013 0.925 . . . . 0.0 110.442 173.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -61.11 -42.99 99.55 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.089 0.859 . . . . 0.0 112.865 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.3 m -63.39 -35.13 79.37 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.764 0.826 . . . . 0.0 112.668 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -80.73 -34.15 34.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.28 1.032 . . . . 0.0 112.478 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -62.92 -34.61 77.8 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.211 0.914 . . . . 0.0 110.963 168.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -71.31 -17.65 62.44 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.5 mt -59.41 -46.48 88.58 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.678 1.126 . . . . 0.0 110.605 161.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.4 mt -77.24 -30.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.383 1.073 . . . . 0.0 111.206 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.1 m -62.64 -41.49 99.07 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.662 -1.274 . . . . 0.0 111.113 174.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.92 -30.26 61.2 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 174.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -137.78 62.02 32.45 Favored Pre-proline 0 CA--C 1.556 1.209 0 C-N-CA 124.542 1.137 . . . . 0.0 113.391 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -61.89 -27.97 80.68 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.549 2.166 . . . . 0.0 116.429 -165.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -103.03 -1.43 29.26 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.186 0.995 . . . . 0.0 113.082 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -84.33 123.9 74.43 Favored Pre-proline 0 CA--C 1.543 0.695 0 O-C-N 120.878 -1.139 . . . . 0.0 112.179 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -55.24 -23.81 38.87 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.478 . . . . 0.0 114.928 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.72 -38.95 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.471 1.032 . . . . 0.0 112.844 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.08 -46.31 59.14 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 119.305 0.957 . . . . 0.0 111.521 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -62.91 -40.46 97.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.47 1.108 . . . . 0.0 112.189 173.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.2 m -58.96 -34.5 71.85 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.241 1.016 . . . . 0.0 112.626 174.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.46 -44.19 17.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.794 0.838 . . . . 0.0 111.337 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -60.08 -34.7 73.81 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 121.087 1.767 . . . . 0.0 112.196 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.14 -34.18 77.06 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 168.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.1 tpt -66.11 -44.29 84.75 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.272 1.029 . . . . 0.0 111.727 172.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.62 -45.9 88.23 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.087 0.955 . . . . 0.0 112.065 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.55 -36.02 77.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 118.789 -0.624 . . . . 0.0 112.666 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.1 pt -84.08 -17.24 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 173.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -21.45 46.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.066 1.346 . . . . 0.0 112.049 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -88.2 -63.15 1.34 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.327 1.851 . . . . 0.0 109.542 172.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.66 15.77 0.73 Allowed Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.276 1.271 . . . . 0.0 116.276 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.06 59.71 1.98 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.304 1.552 . . . . 0.0 109.648 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.1 -30.33 68.02 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.602 1.161 . . . . 0.0 113.509 -173.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.7 m -70.11 -20.46 63.19 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.968 0.804 . . . . 0.0 112.176 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -79.09 -34.3 43.69 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.35 -1.469 . . . . 0.0 112.149 166.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.87 -45.5 64.3 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.8 pt -59.56 -40.49 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 CA-C-N 119.411 1.005 . . . . 0.0 111.857 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.0 tm0? -63.35 -49.08 75.31 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.461 1.104 . . . . 0.0 110.924 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.9 ttm -66.11 -28.14 68.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -64.69 -47.26 79.02 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.137 -0.977 . . . . 0.0 111.415 171.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -67.91 -36.09 79.59 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.932 0.493 . . . . 0.0 111.867 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -35.43 74.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.544 0.738 . . . . 0.0 112.565 166.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -73.13 -28.56 66.14 Favored Glycine 0 N--CA 1.471 1.006 0 CA-C-N 120.17 1.35 . . . . 0.0 114.433 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.06 -26.05 68.66 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.371 1.585 . . . . 0.0 112.688 175.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -59.23 -16.96 24.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.103 1.361 . . . . 0.0 114.447 172.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -95.92 13.7 25.97 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.189 1.795 . . . . 0.0 113.967 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.258 16.4 p -122.51 -126.06 0.26 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.51 1.124 . . . . 0.0 113.171 -164.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 74.5 m 56.32 27.33 11.74 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 126.983 2.113 . . . . 0.0 116.475 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.6 t -149.38 154.21 38.57 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.534 -1.354 . . . . 0.0 113.04 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.89 66.94 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 -167.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -77.54 -6.73 54.65 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -124.22 6.97 8.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.512 1.525 . . . . 0.0 113.356 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -64.61 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.357 -1.464 . . . . 0.0 113.553 -173.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.93 -42.23 66.9 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.304 -0.873 . . . . 0.0 111.308 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.24 -41.0 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.05 0.94 . . . . 0.0 111.804 170.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 69.0 ttt-85 -58.18 -47.54 83.11 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.141 0.576 . . . . 0.0 109.868 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.3 m -65.17 -32.3 73.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 117.424 -1.274 . . . . 0.0 113.895 175.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -55.19 -48.33 73.95 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.674 1.579 . . . . 0.0 110.997 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -75.5 -29.02 59.39 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 31.2 mm100 -61.18 -50.48 72.96 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.556 1.525 . . . . 0.0 111.828 170.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -37.04 49.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.015 -0.517 . . . . 0.0 111.8 -174.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -59.48 -35.4 74.03 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.189 0.904 . . . . 0.0 111.588 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.03 -45.96 83.28 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.224 0.92 . . . . 0.0 112.102 172.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.53 -26.78 63.73 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.3 tt -89.61 -28.72 19.34 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.832 0.742 . . . . 0.0 112.622 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.22 -46.05 86.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.534 1.516 . . . . 0.0 111.727 173.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.57 -23.87 67.41 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.686 0.794 . . . . 0.0 112.814 171.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.85 -55.96 10.2 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.833 2.159 . . . . 0.0 114.29 170.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.62 -25.98 64.2 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.138 -1.213 . . . . 0.0 113.221 -176.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.1 p -80.99 -9.56 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 121.212 -0.93 . . . . 0.0 113.219 168.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.44 9.15 84.48 Favored Glycine 0 CA--C 1.535 1.286 0 O-C-N 120.719 -1.238 . . . . 0.0 115.32 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.8 m -75.81 -1.64 26.13 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.783 1.292 . . . . 0.0 114.008 -177.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.3 t -60.32 131.97 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-N 119.268 0.94 . . . . 0.0 110.686 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -121.05 144.6 48.46 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.954 1.702 . . . . 0.0 110.388 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 31.2 mt 58.64 76.53 0.45 Allowed Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.881 1.672 . . . . 0.0 111.639 176.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -80.92 4.42 6.98 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.563 2.175 . . . . 0.0 114.129 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.2 t 62.26 65.67 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.948 1.699 . . . . 0.0 112.477 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.0 t -142.72 89.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.489 1.116 . . . . 0.0 111.111 -175.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 48.13 -63.65 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 130.104 3.362 . . . . 0.0 118.971 165.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 p -166.39 -34.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 126.936 2.094 . . . . 0.0 112.755 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.76 -41.62 64.89 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.52 1.674 . . . . 0.0 115.52 -162.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -115.68 26.11 10.27 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.187 -0.946 . . . . 0.0 113.243 -164.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mt -105.3 160.37 26.26 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 125.791 1.636 . . . . 0.0 110.139 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -62.46 -24.62 75.57 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.727 2.285 . . . . 0.0 115.234 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -147.32 -46.21 0.17 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.17 0.988 . . . . 0.0 113.248 168.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 170.21 27.95 0.02 OUTLIER Glycine 0 CA--C 1.536 1.398 0 N-CA-C 116.579 1.391 . . . . 0.0 116.579 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -51.81 -36.96 49.83 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -167.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.16 -29.44 65.21 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.769 -1.207 . . . . 0.0 113.719 177.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 42.35 76.34 0.08 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 128.471 2.708 . . . . 0.0 115.455 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 63.2 m . . . . . 0 C--O 1.251 1.15 0 C-N-CA 124.83 1.252 . . . . 0.0 113.546 171.602 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 14.5 mmt . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 119.803 -0.141 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -108.78 165.52 11.5 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.951 1.3 . . . . 0.0 111.47 175.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -158.47 153.61 25.45 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 120.399 -1.438 . . . . 0.0 114.775 175.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.68 179.18 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 127.209 2.204 . . . . 0.0 112.821 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.796 1.638 . . . . 0.0 115.134 -174.457 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 tmm? . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 121.386 0.612 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.4 m -66.52 -39.7 88.77 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.23 1.412 . . . . 0.0 114.345 -161.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -63.45 -22.18 66.74 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -38.87 10.08 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.705 1.138 . . . . 0.0 112.802 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -66.02 -16.12 63.63 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -33.15 22.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.901 0.881 . . . . 0.0 113.37 166.247 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -70.38 -36.56 74.18 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.324 -0.86 . . . . 0.0 112.189 -172.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -57.7 -41.04 80.89 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.438 1.095 . . . . 0.0 112.651 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -69.67 -34.52 74.1 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.043 0.537 . . . . 0.0 111.971 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -65.24 -34.4 78.27 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.259 1.024 . . . . 0.0 111.537 169.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.42 -49.19 58.19 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.294 1.426 . . . . 0.0 113.952 170.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -55.29 -34.63 64.29 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 118.632 1.216 . . . . 0.0 110.951 171.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.9 t -70.63 -40.62 72.99 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.46 1.104 . . . . 0.0 113.487 172.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.3 mt -57.34 -41.09 79.33 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.22 1.373 . . . . 0.0 111.314 174.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.527 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 83.8 m-85 -58.46 -39.98 81.41 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.132 0.878 . . . . 0.0 111.703 170.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -31.3 72.46 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.719 1.208 . . . . 0.0 114.079 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.71 -8.01 59.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.738 1.215 . . . . 0.0 113.761 171.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.495 ' HA2' ' CE1' ' A' ' 20' ' ' TYR . . . 91.16 6.2 66.91 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.995 -1.066 . . . . 0.0 114.437 -173.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 47.2 mt -82.86 44.51 0.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.49 1.516 . . . . 0.0 110.615 -177.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.495 ' CE1' ' HA2' ' A' ' 18' ' ' GLY . 5.0 m-85 -55.76 -34.86 65.6 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 113.032 -168.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -76.84 -35.52 57.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 120.503 1.502 . . . . 0.0 112.116 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.13 -24.48 62.28 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.206 0.603 . . . . 0.0 112.268 168.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -79.92 -35.47 37.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.958 0.903 . . . . 0.0 113.105 174.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.97 -40.36 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 O-C-N 121.015 -1.053 . . . . 0.0 110.402 168.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.01 -35.84 64.81 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.122 0.569 . . . . 0.0 112.026 169.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 t -67.81 -50.86 54.54 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.726 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -34.98 76.01 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.536 1.062 . . . . 0.0 111.58 178.1 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -62.21 -29.77 70.61 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.611 0.764 . . . . 0.0 112.679 174.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -65.93 -39.78 90.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.245 1.384 . . . . 0.0 111.714 171.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.5 mt -64.54 -37.63 88.22 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.855 -0.528 . . . . 0.0 110.511 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -80.33 -20.72 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 C-N-CA 125.458 1.503 . . . . 0.0 111.533 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.4 m -78.55 -44.44 24.21 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.156 -1.59 . . . . 0.0 111.588 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -91.57 -20.66 21.44 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -133.92 62.26 56.63 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 124.833 1.253 . . . . 0.0 112.169 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -57.45 -27.49 76.33 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.994 3.129 . . . . 0.0 118.699 -164.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -115.48 11.97 16.1 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.416 ' HB3' HG12 ' A' ' 39' ' ' VAL . 3.9 m120 -76.01 134.73 71.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 O-C-N 121.57 -0.706 . . . . 0.0 110.479 170.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' HB2' HG21 ' A' ' 76' ' ' ILE . 43.8 Cg_endo -55.54 -25.56 50.19 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.638 2.892 . . . . 0.0 113.932 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.416 HG12 ' HB3' ' A' ' 37' ' ' ASN . 6.0 p -55.01 -44.71 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 C-N-CA 125.339 1.456 . . . . 0.0 113.687 -175.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.04 -36.61 91.04 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -69.24 -36.68 77.44 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.122 0.969 . . . . 0.0 111.673 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.7 t -64.42 -42.91 95.78 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.361 -0.837 . . . . 0.0 112.278 172.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -75.43 -24.27 57.04 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -72.78 -37.43 67.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.212 1.005 . . . . 0.0 112.095 168.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.96 89.34 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.069 -1.019 . . . . 0.0 111.829 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.507 ' SD ' ' HE2' ' A' ' 50' ' ' LYS . 33.3 tpp -62.28 -45.53 92.84 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 112.135 171.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.26 -43.4 78.68 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.498 -0.751 . . . . 0.0 112.317 173.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.82 -41.03 92.32 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.699 0.8 . . . . 0.0 112.683 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 43.0 pt -68.85 -35.67 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.407 1.458 . . . . 0.0 112.287 172.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.507 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.2 OUTLIER -74.05 4.73 5.08 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 173.501 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.9 mt -122.19 3.55 9.82 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 128.26 2.624 . . . . 0.0 113.425 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.1 14.23 77.46 Favored Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.57 47.19 1.06 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.239 1.816 . . . . 0.0 111.86 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -60.05 -34.77 73.87 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.987 -1.071 . . . . 0.0 112.845 -171.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.32 -25.55 68.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.627 1.171 . . . . 0.0 112.532 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -81.29 -41.18 22.53 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.437 0.562 . . . . 0.0 111.054 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.76 88.54 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -175.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.2 pt -64.73 -35.15 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.779 0.718 . . . . 0.0 112.498 174.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -72.22 -44.23 63.24 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.782 0.833 . . . . 0.0 111.046 173.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.4 ttm -62.52 -30.02 70.99 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.885 0.874 . . . . 0.0 112.75 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 91.1 m -65.85 -39.14 90.48 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.99 -1.069 . . . . 0.0 112.113 171.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -70.67 -39.87 73.3 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.858 0.863 . . . . 0.0 112.077 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -35.59 77.36 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.361 0.664 . . . . 0.0 111.529 166.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.22 -31.21 78.48 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 120.539 -1.351 . . . . 0.0 113.279 175.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 98.2 mt -63.56 -29.18 70.47 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.032 1.416 . . . . 0.0 112.808 173.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -66.39 -8.03 23.03 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 170.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -102.68 11.59 37.48 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.036 1.735 . . . . 0.0 112.606 168.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.8 p -126.97 19.28 7.1 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.568 1.547 . . . . 0.0 113.932 -178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 m -81.8 3.83 24.44 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.897 1.279 . . . . 0.0 113.725 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -143.26 150.56 39.44 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 111.328 -166.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.2 -26.1 37.11 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.945 2.202 . . . . 0.0 116.945 -161.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -74.61 -4.81 39.34 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.736 1.153 . . . . 0.0 113.97 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -135.51 11.78 3.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.787 1.235 . . . . 0.0 113.908 -168.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.01 -9.36 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 O-C-N 120.322 -1.486 . . . . 0.0 114.94 -175.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.93 24.52 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.39 0.996 . . . . 0.0 110.459 158.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.479 HG21 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm -62.28 -27.89 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 O-C-N 120.866 -1.146 . . . . 0.0 112.041 174.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -48.35 -38.88 20.32 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.727 1.211 . . . . 0.0 112.438 168.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.7 m -79.36 -35.34 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.225 1.01 . . . . 0.0 113.465 170.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.437 ' HE2' ' SD ' ' B' ' -4' ' ' MET 0.272 20.9 ttpt -73.69 9.66 1.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 170.464 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.89 -32.05 7.43 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.723 -1.236 . . . . 0.0 112.855 152.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -81.89 -31.39 31.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.51 -36.15 82.99 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 121.07 1.759 . . . . 0.0 110.191 163.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -63.55 -35.59 80.98 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.521 1.128 . . . . 0.0 111.446 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 21.3 tp -64.18 -45.04 90.11 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.014 1.325 . . . . 0.0 112.576 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -63.57 -32.53 74.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.058 -1.026 . . . . 0.0 113.062 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.9 -29.07 32.54 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.516 1.527 . . . . 0.0 112.499 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.02 -44.82 75.63 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.536 -1.352 . . . . 0.0 111.182 168.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -57.7 -27.34 62.84 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.793 0.837 . . . . 0.0 111.657 165.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.27 -61.8 6.26 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 128.885 3.136 . . . . 0.0 113.234 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.14 -31.28 68.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.866 1.266 . . . . 0.0 113.268 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.8 p -75.43 -29.96 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.462 0.574 . . . . 0.0 111.742 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -75.9 -109.33 0.12 Allowed Glycine 0 CA--C 1.53 1.026 0 C-N-CA 125.304 1.43 . . . . 0.0 111.949 171.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.7 m 58.95 31.61 21.5 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.76 1.224 . . . . 0.0 114.201 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -96.13 117.63 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 120.703 -1.248 . . . . 0.0 109.5 169.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -76.16 149.12 37.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.829 0.851 . . . . 0.0 112.554 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 59.1 mt 62.11 88.49 0.12 Allowed Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 126.157 1.783 . . . . 0.0 110.407 -168.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.4 -9.83 10.14 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.0 114.197 -175.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.9 t 55.56 69.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 123.133 1.444 . . . . 0.0 112.847 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.3 m -136.39 153.53 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 126.675 1.99 . . . . 0.0 109.586 -178.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.12 -47.13 84.09 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.583 0.629 . . . . 0.0 112.66 -167.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 m -145.72 140.71 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 126.964 2.106 . . . . 0.0 109.198 165.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -165.8 -128.91 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.942 1.297 . . . . 0.0 109.489 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -109.03 -43.83 4.1 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.904 1.682 . . . . 0.0 112.603 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.4 mp 56.58 -178.92 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 176.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -57.23 163.84 7.55 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 121.965 1.777 . . . . 0.0 114.028 170.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -62.76 124.39 20.9 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.816 -1.178 . . . . 0.0 111.837 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.72 -1.76 61.27 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.627 1.584 . . . . 0.0 115.831 -176.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -71.25 -53.26 14.94 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.037 1.419 . . . . 0.0 113.783 -169.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -151.05 113.79 4.7 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.218 1.008 . . . . 0.0 113.529 169.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -111.97 21.44 15.93 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.706 2.002 . . . . 0.0 113.471 -174.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 68.1 m . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.49 1.916 . . . . 0.0 112.119 -158.988 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' -4' ' ' MET . . . . . 0.437 ' SD ' ' HE2' ' A' ' 79' ' ' LYS . 10.2 ttt . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.61 157.06 38.15 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -156.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -149.86 179.31 8.14 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.593 2.357 . . . . 0.0 109.832 163.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 39.2 t -84.65 103.02 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 O-C-N 120.462 -1.399 . . . . 0.0 111.434 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 . . . . . 0 C--O 1.254 1.333 0 C-N-CA 127.304 2.242 . . . . 0.0 113.996 179.769 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.6 mtt . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -63.43 -39.11 93.6 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -162.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.41 -30.69 71.73 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.928 1.24 . . . . 0.0 112.337 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.37 -39.31 59.33 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.308 9.7 pt-20 -75.75 -10.0 59.06 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.33 0.968 . . . . 0.0 112.941 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -75.13 -57.53 3.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.254 1.422 . . . . 0.0 111.656 156.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -65.07 -34.93 79.59 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -167.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -65.18 -19.87 66.18 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -105.69 -21.36 13.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.616 1.566 . . . . 0.0 113.178 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -55.45 -34.73 64.75 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.158 1.345 . . . . 0.0 111.334 163.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -57.79 -28.96 61.02 Favored Glycine 0 CA--C 1.539 1.59 0 CA-C-O 119.016 -0.88 . . . . 0.0 114.724 172.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -60.76 -49.79 76.09 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.752 1.776 . . . . 0.0 111.87 174.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.5 t -68.92 -30.0 68.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.718 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 76.6 mt -64.31 -41.49 96.8 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.573 -1.329 . . . . 0.0 112.172 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -61.1 -34.94 75.75 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.376 -0.827 . . . . 0.0 112.643 168.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.2 -22.85 51.74 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -78.33 -26.31 46.8 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.436 1.094 . . . . 0.0 111.867 164.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.2 14.16 39.89 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.407 1.003 . . . . 0.0 113.951 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.43 58.62 4.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 127.228 2.211 . . . . 0.0 109.367 178.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -57.47 -36.45 71.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.782 0.833 . . . . 0.0 112.911 -172.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -79.86 -28.5 40.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.532 1.06 . . . . 0.0 111.553 -176.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -69.49 -38.11 77.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.664 0.785 . . . . 0.0 112.412 163.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -32.93 74.3 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 176.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.6 t -69.01 -38.97 79.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.138 0.975 . . . . 0.0 111.033 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -60.73 -33.77 73.41 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.141 -0.974 . . . . 0.0 113.002 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 p -74.01 -34.86 64.31 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 117.763 -1.113 . . . . 0.0 113.942 173.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.251 0.2 OUTLIER -67.09 -33.92 76.51 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.136 1.789 . . . . 0.0 111.693 169.898 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -62.53 -28.34 69.78 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.413 -0.804 . . . . 0.0 111.892 175.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -68.36 -33.8 74.93 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.709 -1.244 . . . . 0.0 112.539 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.63 -44.27 62.16 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.881 0.764 . . . . 0.0 109.19 177.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -70.85 -20.63 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.073 0.949 . . . . 0.0 112.103 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.5 m -68.63 -39.83 80.6 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.416 -1.428 . . . . 0.0 111.431 168.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -90.3 -28.22 18.91 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -177.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -132.29 60.26 49.64 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 126.151 1.78 . . . . 0.0 111.96 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -59.86 -26.56 82.66 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.195 2.596 . . . . 0.0 115.983 -170.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -106.97 4.44 27.17 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.492 1.517 . . . . 0.0 112.339 -170.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -93.13 130.32 36.4 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 120.813 -1.179 . . . . 0.0 112.969 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.41 -24.05 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.754 2.303 . . . . 0.0 114.107 174.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.49 -30.33 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 173.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.62 -42.35 55.01 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.357 -0.839 . . . . 0.0 111.121 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.45 -29.87 61.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 26.5 p -66.15 -42.9 88.42 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.105 1.321 . . . . 0.0 111.206 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -67.9 -44.51 76.81 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.475 0.71 . . . . 0.0 111.479 176.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -59.22 -41.91 89.76 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.851 0.86 . . . . 0.0 112.399 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.81 -37.29 86.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.379 0.991 . . . . 0.0 112.505 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.6 tpt -70.02 -39.58 75.71 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.626 0.648 . . . . 0.0 111.927 175.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.73 99.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.756 0.822 . . . . 0.0 111.735 172.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.84 -45.04 93.65 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.581 -0.699 . . . . 0.0 111.506 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 29.3 pt -68.44 -30.45 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.028 1.286 . . . . 0.0 112.87 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -11.37 59.85 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 175.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.6 tt -88.97 -29.08 19.79 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.07 1.748 . . . . 0.0 111.084 164.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 107.27 15.42 15.89 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.687 1.613 . . . . 0.0 114.695 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.93 48.71 1.06 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.312 2.245 . . . . 0.0 110.751 -178.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -59.85 -32.6 70.85 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.67 -1.269 . . . . 0.0 112.974 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 55.4 m -55.82 -31.35 62.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.162 1.785 . . . . 0.0 112.787 171.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -79.5 -39.08 32.9 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.669 0.788 . . . . 0.0 111.206 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.43 -39.61 89.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.869 0.868 . . . . 0.0 112.758 -176.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -65.2 -30.54 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.262 0.937 . . . . 0.0 112.912 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -77.35 -36.23 53.96 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.988 0.915 . . . . 0.0 111.698 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.9 ttm -66.65 -30.97 71.36 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 0.0 112.561 173.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 86.8 m -61.92 -43.16 99.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.321 -0.862 . . . . 0.0 111.927 171.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -65.94 -40.0 90.97 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.756 1.223 . . . . 0.0 112.916 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.26 -27.68 69.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.153 0.581 . . . . 0.0 112.312 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -22.17 61.25 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 120.606 -1.309 . . . . 0.0 114.717 174.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.4 mt -59.21 -27.35 65.65 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.847 1.824 . . . . 0.0 112.263 171.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -59.88 -10.76 4.33 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.397 1.879 . . . . 0.0 115.458 174.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -124.28 42.0 3.36 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.331 1.853 . . . . 0.0 112.712 -168.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.2 p -129.88 -12.68 4.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -164.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 60.4 m -81.64 49.46 1.33 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -168.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.2 t -164.07 153.35 13.96 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.904 1.681 . . . . 0.0 110.518 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.77 -11.08 32.73 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 120.993 -1.067 . . . . 0.0 113.139 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.49 -31.82 73.09 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.618 1.167 . . . . 0.0 111.932 165.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -130.87 16.87 5.19 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.238 1.415 . . . . 0.0 113.82 -169.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.6 p -69.98 -28.1 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 120.505 -1.372 . . . . 0.0 113.069 178.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.65 -34.99 22.93 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.36 0.664 . . . . 0.0 111.294 170.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 12.8 mm -51.38 -41.72 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 121.468 -0.77 . . . . 0.0 111.052 166.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -55.26 -47.33 75.62 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.847 0.749 . . . . 0.0 111.533 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.6 m -61.86 -42.29 98.87 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.975 1.31 . . . . 0.0 111.875 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -70.32 -4.02 20.13 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.577 1.551 . . . . 0.0 114.153 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -102.76 -31.62 10.23 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.8 1.182 . . . . 0.0 112.983 157.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 -61.12 -53.59 55.14 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.837 1.653 . . . . 0.0 112.079 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -33.65 68.59 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.288 0.495 . . . . 0.0 111.105 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 tpp85 -66.3 -33.2 75.21 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.678 1.191 . . . . 0.0 111.684 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tt -66.82 -50.78 61.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.39 0.676 . . . . 0.0 110.445 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.03 -37.16 71.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 177.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.32 -26.35 35.7 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.925 1.29 . . . . 0.0 112.689 178.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.71 -42.62 90.89 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.743 1.61 . . . . 0.0 110.484 169.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.51 -29.54 70.57 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.453 0.701 . . . . 0.0 111.274 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.93 -60.33 8.61 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 127.756 2.598 . . . . 0.0 113.694 172.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.61 -27.24 68.51 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.419 1.887 . . . . 0.0 113.027 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p -93.68 -18.21 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.03 27.41 53.12 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.547 1.07 . . . . 0.0 114.703 -178.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.1 m -78.19 89.74 4.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.734 1.267 . . . . 0.0 111.202 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 13.0 p -148.16 148.88 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 125.283 1.433 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -135.57 173.72 11.4 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.577 . . . . 0.0 110.966 173.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.5 mt 47.83 65.43 7.04 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.954 1.702 . . . . 0.0 110.516 -174.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -83.24 -0.02 9.74 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.41 2.074 . . . . 0.0 113.059 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 t 53.26 49.56 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.233 1.413 . . . . 0.0 112.617 176.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 27.3 m -130.72 41.75 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 126.534 1.934 . . . . 0.0 111.051 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . 0.259 3.4 mp0 67.84 171.27 0.27 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 128.436 2.695 . . . . 0.0 115.922 174.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.35 -8.08 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -159.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -84.14 -8.2 59.16 Favored 'General case' 0 CA--C 1.553 1.091 0 O-C-N 120.512 -1.368 . . . . 0.0 112.161 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -130.47 -14.24 3.74 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 173.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 88.3 mt -64.7 164.13 22.95 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 120.877 -1.139 . . . . 0.0 111.949 165.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -56.01 151.86 39.8 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.335 2.69 . . . . 0.0 113.843 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -63.69 120.75 12.41 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.297 -0.877 . . . . 0.0 111.266 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.17 -6.31 79.92 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.628 1.585 . . . . 0.0 115.898 -174.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -87.14 128.86 35.12 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.86 1.83 . . . . 0.0 111.842 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.0 t0 56.79 172.79 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.235 1.814 . . . . 0.0 114.763 -174.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -142.52 152.78 43.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.255 1.822 . . . . 0.0 111.86 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.251 1.136 0 C-N-CA 126.061 1.744 . . . . 0.0 111.551 172.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -73.6 -0.82 16.45 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.616 1.709 . . . . 0.0 115.616 -173.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 61.37 -118.31 0.71 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.352 1.861 . . . . 0.0 112.374 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 54.8 t -133.62 90.23 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.467 1.507 . . . . 0.0 108.457 -170.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . 0.323 0.2 OUTLIER . . . . . 0 C--O 1.254 1.304 0 C-N-CA 128.213 2.605 . . . . 0.0 115.277 -172.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.876 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.6 p -67.94 -22.63 65.04 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.051 -1.655 . . . . 0.0 114.051 -176.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -65.04 -39.29 93.13 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.469 1.031 . . . . 0.0 111.309 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -15.42 60.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 174.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -75.49 -50.89 14.33 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.756 -1.215 . . . . 0.0 111.429 164.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.276 0.0 OUTLIER -67.22 -29.4 69.04 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.853 1.206 . . . . 0.0 113.658 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.34 -39.14 71.51 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.023 1.283 . . . . 0.0 112.764 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -65.99 -20.44 66.19 Favored 'General case' 0 N--CA 1.485 1.289 0 O-C-N 120.886 -1.134 . . . . 0.0 113.111 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -95.54 -32.44 12.84 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.096 0.958 . . . . 0.0 112.568 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -59.07 -42.94 91.55 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.253 1.021 . . . . 0.0 111.045 170.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.6 -39.65 61.12 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-N 118.82 0.736 . . . . 0.0 113.753 173.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -70.1 -39.9 75.24 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.607 1.204 . . . . 0.0 111.178 177.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.3 t -60.29 -43.08 96.58 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 122.782 0.433 . . . . 0.0 111.426 172.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.8 mt -59.38 -40.66 87.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.222 -0.924 . . . . 0.0 111.652 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.141 1.337 . . . . 0.0 113.022 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.471 ' N ' ' HE2' ' A' ' 16' ' ' LYS . 1.1 mpmm? -68.11 -18.21 64.58 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 175.282 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -91.89 -7.14 50.08 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.912 1.285 . . . . 0.0 113.124 166.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.21 9.22 86.84 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 121.136 -0.977 . . . . 0.0 114.965 -175.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.0 mt -80.23 46.86 0.86 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.888 2.075 . . . . 0.0 111.893 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -50.7 -41.68 56.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.012 1.725 . . . . 0.0 113.431 -173.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -73.28 -27.4 61.54 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.288 0.949 . . . . 0.0 111.76 -175.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -81.88 -36.07 28.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.507 0.723 . . . . 0.0 111.065 170.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.24 71.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.624 1.17 . . . . 0.0 113.079 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.7 t -56.98 -40.86 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.771 1.228 . . . . 0.0 110.922 177.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.61 -42.07 98.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.538 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -61.26 -46.21 91.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 0.0 112.149 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -65.46 -33.23 75.45 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -69.62 -28.04 65.58 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.708 0.686 . . . . 0.0 112.362 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -66.42 -31.65 72.54 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.525 1.057 . . . . 0.0 112.096 173.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.3 mt -58.3 -37.7 75.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.423 1.011 . . . . 0.0 111.209 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -79.51 -22.92 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 122.711 0.405 . . . . 0.0 111.888 177.132 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -69.77 -41.46 75.14 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.798 -1.189 . . . . 0.0 111.083 169.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.21 -34.54 23.9 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -176.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -124.67 66.56 47.52 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 125.345 1.458 . . . . 0.0 112.697 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -58.39 -22.4 58.31 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.632 2.888 . . . . 0.0 119.01 -166.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -122.23 16.3 10.65 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.54 1.064 . . . . 0.0 112.653 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.7 m120 -89.5 124.29 64.65 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 111.215 174.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.24 -16.35 53.9 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.417 2.078 . . . . 0.0 113.949 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.48 HG12 ' HB3' ' A' ' 37' ' ' ASN . 4.4 p -51.58 -46.77 37.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.56 1.073 . . . . 0.0 111.892 171.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.26 -43.42 92.95 Favored Glycine 0 C--N 1.34 0.766 0 C-N-CA 123.522 0.582 . . . . 0.0 111.934 -176.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -58.89 -37.81 77.44 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 117.611 0.705 . . . . 0.0 112.431 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.4 p -65.35 -38.05 88.93 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.774 -1.204 . . . . 0.0 112.886 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -76.02 -37.11 58.79 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.83 0.852 . . . . 0.0 111.995 178.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.18 -33.46 70.01 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.9 -1.125 . . . . 0.0 112.505 175.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.43 83.49 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 120.922 -1.112 . . . . 0.0 111.717 166.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.4 tpt -63.35 -43.45 97.67 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.128 0.571 . . . . 0.0 111.812 173.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.16 -44.78 83.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.084 0.954 . . . . 0.0 112.1 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -64.18 -34.25 77.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.75 0.82 . . . . 0.0 112.848 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.3 pt -80.54 -17.14 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.735 1.152 . . . . 0.0 114.07 171.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.41 -13.13 53.03 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.466 1.506 . . . . 0.0 113.222 171.38 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 tt -101.82 -38.68 7.74 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.914 2.086 . . . . 0.0 112.077 173.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.19 22.44 5.88 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 124.726 1.155 . . . . 0.0 115.678 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -103.75 53.89 0.75 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.598 1.19 . . . . 0.0 109.094 169.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.51 -34.0 66.57 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 112.83 -173.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.9 m -64.82 -26.34 68.3 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.89 0.768 . . . . 0.0 112.144 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -75.62 -33.4 60.51 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.034 -1.041 . . . . 0.0 112.015 169.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.0 -40.59 71.76 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 112.75 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 25.4 pt -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.938 0.79 . . . . 0.0 112.068 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -62.38 -46.83 86.85 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.882 0.873 . . . . 0.0 110.985 170.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 50.3 ttm -62.2 -32.28 72.91 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.59 -0.693 . . . . 0.0 112.834 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.73 -49.53 62.13 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.051 -1.031 . . . . 0.0 112.031 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.43 -33.96 77.17 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 122.971 0.509 . . . . 0.0 111.811 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -65.31 -26.37 68.03 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.462 1.505 . . . . 0.0 113.349 169.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.44 -31.55 37.06 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 120.335 -1.478 . . . . 0.0 114.11 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.0 -32.01 70.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.611 1.705 . . . . 0.0 112.161 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -52.77 -22.63 5.53 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.48 1.512 . . . . 0.0 114.581 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -81.42 -12.83 58.81 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.439 1.495 . . . . 0.0 114.145 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -103.03 10.57 38.04 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 118.188 2.662 . . . . 0.0 118.188 -148.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -76.71 37.24 0.17 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.5 t -151.59 148.55 28.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.591 1.556 . . . . 0.0 111.278 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.31 -15.47 16.24 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 172.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -67.77 -26.83 66.31 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.174 0.897 . . . . 0.0 112.111 169.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -128.03 17.09 6.72 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.683 1.593 . . . . 0.0 113.665 -174.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.2 p -63.42 -31.17 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 120.093 -1.63 . . . . 0.0 112.595 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.02 -10.5 59.77 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.02 1.328 . . . . 0.0 113.756 174.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.3 mm -84.3 -35.85 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.829 1.251 . . . . 0.0 110.339 168.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -57.2 -39.35 75.24 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.694 1.198 . . . . 0.0 111.731 176.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.2 p -71.14 -47.5 57.49 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.082 0.953 . . . . 0.0 112.544 171.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 mttm -48.56 -57.26 6.45 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.403 1.002 . . . . 0.0 111.838 176.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.15 -30.07 67.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 117.979 -1.01 . . . . 0.0 112.976 -173.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -76.55 -38.06 55.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.651 1.569 . . . . 0.0 113.602 175.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.23 -39.2 65.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.703 1.138 . . . . 0.0 111.321 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.369 15.6 ptp180 -77.04 -11.24 59.78 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.448 1.476 . . . . 0.0 114.412 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.5 -41.44 55.32 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.248 1.019 . . . . 0.0 112.171 161.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.62 -39.19 83.45 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.104 -0.998 . . . . 0.0 111.343 167.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.47 -28.05 41.54 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.394 1.078 . . . . 0.0 113.572 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.72 89.07 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.751 1.16 . . . . 0.0 110.986 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.0 -26.96 68.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.839 0.856 . . . . 0.0 111.423 170.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.28 -49.65 55.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.728 2.109 . . . . 0.0 114.421 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.99 -27.14 61.62 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.611 -0.935 . . . . 0.0 112.562 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p -90.16 -12.17 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 177.45 164.46 31.03 Favored Glycine 0 CA--C 1.541 1.698 0 C-N-CA 124.518 1.056 . . . . 0.0 114.234 174.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.8 m -128.88 3.45 5.37 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -169.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 13.6 p -111.33 118.54 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.247 1.019 . . . . 0.0 109.411 161.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.62 72.07 1.38 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.141 1.377 . . . . 0.0 111.667 -161.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.2 mt -79.07 115.04 49.57 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 168.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.73 -13.68 27.0 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.517 2.812 . . . . 0.0 113.392 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . 0.302 30.8 m 53.47 21.75 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 116.843 2.164 . . . . 0.0 116.843 174.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 97.6 t -133.79 -22.92 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 125.273 1.429 . . . . 0.0 114.086 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -170.71 168.16 7.52 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.777 1.631 . . . . 0.0 113.589 179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 60.8 t -80.89 88.88 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 126.728 2.011 . . . . 0.0 109.583 162.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -118.21 -69.69 0.84 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.836 1.254 . . . . 0.0 111.555 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -107.2 -60.2 1.72 Allowed 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.613 -0.68 . . . . 0.0 110.416 173.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.9 mt 61.91 166.25 0.1 Allowed Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.839 2.056 . . . . 0.0 113.637 -175.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.74 169.59 19.8 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 121.99 1.794 . . . . 0.0 113.497 160.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -64.85 131.87 47.91 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.037 0.935 . . . . 0.0 112.307 172.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.61 -0.65 89.5 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.88 1.229 . . . . 0.0 115.931 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -89.82 -32.46 16.91 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.943 1.372 . . . . 0.0 112.918 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -149.15 170.34 18.64 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.877 1.671 . . . . 0.0 108.01 156.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -129.6 151.66 49.97 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -170.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.757 2.023 . . . . 0.0 112.995 -170.17 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 N--CA 1.481 1.092 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.207 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -91.93 136.66 32.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.997 0.919 . . . . 0.0 112.673 -168.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -78.36 146.83 34.43 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.545 1.138 . . . . 0.0 113.387 -175.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' -1' ' ' VAL . . . . . 0.554 HG22 ' H ' ' B' ' 0' ' ' ASP . 2.7 p -100.22 176.17 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.856 1.662 . . . . 0.0 113.195 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 0' ' ' ASP . . . . . 0.554 ' H ' HG22 ' B' ' -1' ' ' VAL . 24.8 t0 . . . . . 0 C--O 1.252 1.231 0 C-N-CA 127.929 2.492 . . . . 0.0 113.97 -172.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 m -51.31 -23.9 4.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -173.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 mp0 -44.77 -36.45 3.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.52 1.528 . . . . 0.0 114.012 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -34.52 26.13 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.614 1.097 . . . . 0.0 112.981 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -64.06 -23.51 67.35 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.502 1.521 . . . . 0.0 112.535 167.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.85 -46.34 25.07 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 125.962 1.705 . . . . 0.0 111.314 171.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -70.51 -27.25 64.04 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -62.53 -29.19 70.39 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 119.303 0.956 . . . . 0.0 112.967 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -85.83 -30.21 23.15 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 172.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.13 -43.88 91.99 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.983 -1.073 . . . . 0.0 111.091 171.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.22 91.44 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-O 119.231 -0.76 . . . . 0.0 114.079 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -55.21 -54.05 48.32 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.551 1.175 . . . . 0.0 110.358 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.6 t -57.86 -43.69 86.13 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.406 1.082 . . . . 0.0 112.166 177.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.33 -33.07 73.0 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.211 -0.931 . . . . 0.0 112.937 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -66.16 -40.04 90.24 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.844 1.202 . . . . 0.0 113.131 171.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -61.53 -40.43 94.63 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.708 -0.62 . . . . 0.0 112.151 173.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -18.85 64.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.417 1.265 . . . . 0.0 114.417 171.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.99 11.93 69.21 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 123.94 0.781 . . . . 0.0 114.864 -176.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.4 mt -89.03 57.52 4.15 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.234 1.814 . . . . 0.0 109.903 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -56.8 -39.24 73.77 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.939 1.295 . . . . 0.0 114.056 -170.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -83.33 -27.99 29.36 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.124 0.874 . . . . 0.0 111.582 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -70.74 -33.2 70.57 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.175 0.443 . . . . 0.0 111.925 164.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.31 -49.11 68.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.661 0.664 . . . . 0.0 111.803 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.3 t -59.05 -37.03 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.981 -1.009 . . . . 0.0 111.02 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -54.99 -42.14 72.09 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.859 1.209 . . . . 0.0 112.912 174.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.3 m -66.46 -37.06 84.3 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.091 0.859 . . . . 0.0 112.685 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 81.4 m-85 -75.06 -38.27 61.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 175.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -64.23 -35.72 81.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.26 0.624 . . . . 0.0 110.636 173.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -23.31 66.4 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 173.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.3 mt -60.61 -42.17 96.29 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.146 1.339 . . . . 0.0 109.46 168.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.1 mt -82.95 -28.6 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.4 1.48 . . . . 0.0 112.147 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -58.5 -32.87 69.2 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.662 -1.274 . . . . 0.0 111.512 168.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -89.61 -29.09 19.09 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 175.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -136.16 68.85 63.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 124.987 1.315 . . . . 0.0 110.774 -168.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -61.29 -36.8 77.53 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.291 1.994 . . . . 0.0 115.552 -163.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.37 6.8 38.94 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -174.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -105.24 130.49 23.01 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -158.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.49 -17.31 53.09 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.555 2.17 . . . . 0.0 113.414 168.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.78 2.44 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.613 1.565 . . . . 0.0 114.7 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -116.6 -36.97 1.02 Allowed Glycine 0 CA--C 1.531 1.09 0 O-C-N 121.5 -0.75 . . . . 0.0 112.679 155.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -60.29 -44.05 95.72 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.036 1.418 . . . . 0.0 112.881 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.4 p -67.8 -27.36 66.67 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.658 -0.651 . . . . 0.0 112.294 -177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -84.04 -42.24 16.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.495 . . . . 0.0 110.908 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -64.66 -32.12 73.64 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.245 -0.909 . . . . 0.0 112.335 172.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.49 -37.04 85.76 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.125 -0.984 . . . . 0.0 112.633 170.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 tpt -66.14 -38.74 88.87 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.856 0.862 . . . . 0.0 111.735 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.405 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.8 -42.35 93.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.409 0.684 . . . . 0.0 111.831 174.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.2 -36.68 84.93 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 118.58 -0.724 . . . . 0.0 112.68 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.3 pt -68.49 -33.84 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.312 1.415 . . . . 0.0 112.37 169.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.415 ' HE3' HG12 ' B' ' -1' ' ' VAL . 0.3 OUTLIER -78.79 -12.33 60.02 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 179.245 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 -17.14 38.28 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.917 2.087 . . . . 0.0 111.039 163.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.8 22.09 56.34 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.856 1.217 . . . . 0.0 114.308 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -107.73 57.94 0.62 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.891 1.676 . . . . 0.0 110.123 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -56.21 -36.22 68.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.579 1.552 . . . . 0.0 112.497 -175.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.6 m -62.27 -26.73 68.56 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.387 0.994 . . . . 0.0 112.625 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -84.09 -28.74 27.33 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.511 -0.743 . . . . 0.0 111.93 172.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.16 -36.43 58.75 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.177 0.991 . . . . 0.0 113.298 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -68.17 -32.08 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.023 0.829 . . . . 0.0 111.996 175.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -61.55 -50.48 72.47 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.22 0.608 . . . . 0.0 110.049 166.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.5 ttm -69.09 -32.41 71.82 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -174.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -70.35 -39.59 74.58 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.827 -1.171 . . . . 0.0 112.034 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -73.07 -28.68 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.736 1.153 . . . . 0.0 113.394 171.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.73 -32.12 73.51 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.878 -1.139 . . . . 0.0 111.265 166.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.11 -22.7 73.28 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-O 117.87 -1.516 . . . . 0.0 114.514 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.6 mt -56.84 -29.71 63.08 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.288 2.044 . . . . 0.0 112.313 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -64.7 -1.13 1.71 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.193 1.797 . . . . 0.0 114.516 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -130.41 37.65 3.83 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.553 1.941 . . . . 0.0 111.482 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -129.73 -14.19 4.1 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 -167.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.6 m -80.12 22.4 0.52 Allowed 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -163.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 p -141.33 161.27 38.3 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 119.659 1.118 . . . . 0.0 111.97 -173.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.57 67.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -66.91 -18.22 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.237 1.015 . . . . 0.0 113.068 170.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -126.63 14.89 7.59 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.261 1.424 . . . . 0.0 113.88 -173.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.29 -29.99 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.975 -1.078 . . . . 0.0 113.055 177.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.76 -44.94 54.65 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.067 -1.021 . . . . 0.0 110.886 170.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.87 -35.84 53.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.275 1.43 . . . . 0.0 112.459 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 21.6 ttp-105 -58.83 -39.72 82.06 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.23 1.012 . . . . 0.0 112.219 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -77.7 -39.2 45.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.569 1.148 . . . . 0.0 112.234 172.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -68.59 -16.93 64.02 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -178.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -91.07 -32.09 16.01 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.053 1.297 . . . . 0.0 113.705 163.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -78.55 -42.3 29.68 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.402 1.455 . . . . 0.0 113.319 -175.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -34.86 78.74 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.969 1.259 . . . . 0.0 110.814 171.061 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -67.39 -36.93 82.28 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.681 1.593 . . . . 0.0 111.989 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.0 tp -67.96 -39.38 83.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.716 1.206 . . . . 0.0 112.051 170.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.5 -39.89 94.95 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.265 -0.897 . . . . 0.0 112.383 169.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.9 -29.51 62.1 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.981 1.264 . . . . 0.0 112.863 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.47 96.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.96 -1.088 . . . . 0.0 111.169 167.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.496 ' HA ' HG12 ' A' ' 91' ' ' VAL . 38.2 mt-30 -69.99 -19.89 63.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.216 1.006 . . . . 0.0 112.566 172.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -65.86 -62.8 4.46 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.819 2.152 . . . . 0.0 112.757 168.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.97 63.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -175.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 88' ' ' GLN . 0.9 OUTLIER -71.51 -15.4 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.101 -0.999 . . . . 0.0 112.933 171.369 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 74.01 37.42 49.98 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.998 0.817 . . . . 0.0 114.539 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 m -50.87 -33.66 24.88 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.841 1.32 . . . . 0.0 113.948 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.36 146.49 28.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.893 1.277 . . . . 0.0 111.402 165.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -139.04 142.91 38.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.565 1.146 . . . . 0.0 112.195 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.5 mt 60.54 89.94 0.1 OUTLIER Pre-proline 0 N--CA 1.477 0.912 0 C-N-CA 126.486 1.915 . . . . 0.0 111.414 178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -74.18 -7.16 19.46 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.0 2.467 . . . . 0.0 113.429 175.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . 0.258 2.2 t 69.15 43.65 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 125.351 1.461 . . . . 0.0 113.363 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -136.9 152.17 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 129.732 3.213 . . . . 0.0 107.417 171.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -60.91 -40.39 92.96 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 120.164 1.347 . . . . 0.0 113.892 -170.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.3 t -138.55 137.72 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 C-N-CA 125.715 1.606 . . . . 0.0 110.776 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -160.45 -77.71 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.789 1.636 . . . . 0.0 109.642 175.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -135.22 -47.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.428 1.491 . . . . 0.0 109.202 158.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 11.0 mp 63.01 164.38 0.11 Allowed Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 128.061 2.544 . . . . 0.0 113.268 173.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.26 161.73 39.22 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 121.52 1.48 . . . . 0.0 111.441 159.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -55.96 134.0 51.96 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.04 1.336 . . . . 0.0 112.799 -174.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.6 -24.76 2.17 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.668 1.604 . . . . 0.0 115.387 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -62.51 -17.26 59.31 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.028 1.414 . . . . 0.0 113.903 -170.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -63.11 -31.56 72.73 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 172.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? 38.57 32.83 0.06 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 127.218 2.207 . . . . 0.0 114.543 -175.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 59.0 m . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.084 1.354 . . . . 0.0 112.185 -169.757 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -163.79 155.79 17.14 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.429 1.491 . . . . 0.0 112.179 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -147.29 -45.15 0.17 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.375 2.27 . . . . 0.0 111.378 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' -1' ' ' VAL . . . . . 0.415 HG12 ' HE3' ' A' ' 50' ' ' LYS . 49.1 t -140.68 147.28 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.822 1.649 . . . . 0.0 109.688 -175.077 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 124.149 0.979 . . . . 0.0 113.089 177.736 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 tpp . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 119.107 -0.473 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 m -57.48 -25.38 59.66 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 -61.25 -47.99 83.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.871 1.669 . . . . 0.0 111.041 173.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.37 60.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.045 0.938 . . . . 0.0 113.298 176.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.22 -45.13 57.98 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 120.772 -1.205 . . . . 0.0 111.656 165.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -25.63 60.35 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.446 1.475 . . . . 0.0 113.855 178.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -75.58 -26.57 58.03 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.363 0.983 . . . . 0.0 113.274 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -69.33 -39.23 78.32 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.003 -1.061 . . . . 0.0 111.725 170.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.0 -39.06 93.27 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 169.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -59.44 -43.03 93.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.853 0.861 . . . . 0.0 111.479 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.23 -56.15 25.77 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 118.783 0.72 . . . . 0.0 112.183 173.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -54.89 -42.97 72.77 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.942 0.897 . . . . 0.0 111.852 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.8 t -68.88 -38.88 79.96 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.951 1.701 . . . . 0.0 113.43 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.4 mt -65.88 -35.36 80.43 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.779 -1.201 . . . . 0.0 111.322 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -63.3 -40.67 97.99 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.362 0.983 . . . . 0.0 112.269 169.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.06 -33.53 76.0 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.344 -0.847 . . . . 0.0 112.618 177.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.02 -30.82 55.96 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.456 1.102 . . . . 0.0 113.399 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.78 12.36 20.96 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.433 1.492 . . . . 0.0 115.12 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.77 53.79 2.94 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.058 1.743 . . . . 0.0 109.642 174.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -57.61 -36.32 71.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.57 1.148 . . . . 0.0 113.606 -168.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mmt-85 -75.84 -38.37 58.09 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.943 -1.098 . . . . 0.0 111.726 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.78 -31.91 71.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.694 0.397 . . . . 0.0 111.632 172.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.16 98.56 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.04 0.936 . . . . 0.0 112.65 171.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.72 -41.27 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.735 0.814 . . . . 0.0 111.299 173.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.1 m-70 -59.65 -38.46 81.48 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.226 0.921 . . . . 0.0 112.568 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 m -66.28 -26.46 67.34 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 117.72 -1.133 . . . . 0.0 113.573 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.93 -37.49 39.64 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 121.022 1.737 . . . . 0.0 112.261 168.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.87 -29.95 71.14 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.097 0.862 . . . . 0.0 112.094 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -66.64 -36.52 82.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.896 172.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.0 mt -63.8 -41.79 97.84 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.838 1.199 . . . . 0.0 111.217 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.21 -23.09 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.896 0.879 . . . . 0.0 111.019 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.4 m -78.17 -40.81 36.64 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.275 -0.89 . . . . 0.0 111.582 171.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.66 -31.5 24.14 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -129.69 66.39 77.14 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 126.169 1.787 . . . . 0.0 112.02 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -60.01 -26.69 83.11 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 123.297 2.664 . . . . 0.0 116.91 -170.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -106.56 5.86 29.51 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.456 1.503 . . . . 0.0 112.128 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.4 137.63 32.4 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 121.017 -1.052 . . . . 0.0 111.893 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HB2' HG21 ' A' ' 76' ' ' ILE . 57.9 Cg_endo -63.39 -22.78 71.67 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.176 1.917 . . . . 0.0 114.039 176.166 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.1 p -57.82 -42.09 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.971 1.308 . . . . 0.0 113.702 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.65 -40.39 46.37 Favored Glycine 0 N--CA 1.468 0.829 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -64.3 -37.34 87.14 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.239 1.02 . . . . 0.0 111.769 173.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.4 m -59.39 -30.22 68.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.961 0.904 . . . . 0.0 112.676 172.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.274 6.0 m120 -103.36 -16.07 15.74 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -176.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -65.96 -43.09 88.95 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.187 0.903 . . . . 0.0 110.648 155.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.35 89.26 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.143 -0.973 . . . . 0.0 112.661 170.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.2 tpt -62.61 -44.21 96.88 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.606 0.762 . . . . 0.0 112.324 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -46.03 89.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.178 0.991 . . . . 0.0 111.94 175.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.5 mt -59.45 -38.83 81.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.48 0.712 . . . . 0.0 112.349 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.4 pt -77.51 -27.98 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.758 1.163 . . . . 0.0 112.929 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -12.6 61.02 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 171.12 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 mt -118.16 -5.94 10.9 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.866 2.066 . . . . 0.0 114.957 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.32 45.37 8.13 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 119.264 0.938 . . . . 0.0 115.319 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -118.04 49.57 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.821 1.649 . . . . 0.0 110.094 169.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.27 -35.05 71.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.474 1.11 . . . . 0.0 112.959 -168.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.6 m -65.01 -31.26 72.4 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.625 1.17 . . . . 0.0 112.52 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -81.36 -31.31 33.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.087 0.555 . . . . 0.0 110.957 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.44 -44.95 85.71 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.712 -0.618 . . . . 0.0 111.621 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.9 pt -63.95 -29.69 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.997 0.817 . . . . 0.0 113.072 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -63.82 -49.62 72.13 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.49 0.716 . . . . 0.0 110.81 168.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 30.1 ttm -69.61 -26.2 64.32 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 71.0 m -60.25 -45.65 92.52 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.437 -0.789 . . . . 0.0 111.307 170.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -71.13 -40.57 71.31 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.461 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -34.1 71.31 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.3 -0.875 . . . . 0.0 111.756 171.162 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.81 -20.22 74.04 Favored Glycine 0 CA--C 1.533 1.204 0 O-C-N 120.66 -1.275 . . . . 0.0 115.025 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.18 -35.19 73.13 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.971 1.886 . . . . 0.0 111.17 166.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -72.55 -2.56 20.27 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -105.89 -5.12 19.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.953 1.301 . . . . 0.0 112.699 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 74.4 p -137.75 0.97 2.27 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -162.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.4 m -82.04 54.34 2.47 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.613 1.097 . . . . 0.0 111.918 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.6 t -157.94 151.37 23.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.764 1.626 . . . . 0.0 111.867 -175.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -47.96 -31.43 5.26 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.149 1.78 . . . . 0.0 115.312 -177.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -82.83 1.58 38.47 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -145.64 17.8 1.48 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 126.264 1.826 . . . . 0.0 113.625 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -64.34 -25.7 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.643 1.719 . . . . 0.0 115.643 -171.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.96 -20.13 20.27 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.546 1.538 . . . . 0.0 111.859 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.43 HG21 ' HB2' ' A' ' 38' ' ' PRO . 2.4 mm -70.43 -38.22 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 O-C-N 121.285 -0.884 . . . . 0.0 109.685 163.264 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -52.96 -43.44 66.38 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.071 0.948 . . . . 0.0 110.66 173.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -57.4 -39.98 77.27 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.613 1.565 . . . . 0.0 113.944 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.29 -47.02 82.55 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.307 1.412 . . . . 0.0 111.765 169.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.12 -32.99 72.77 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 120.037 1.29 . . . . 0.0 113.21 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -62.17 -50.31 72.36 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.374 1.443 . . . . 0.0 110.92 169.122 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . 0.255 0.0 OUTLIER -71.69 -31.13 66.43 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -173.94 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -52.37 -43.89 64.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.105 0.866 . . . . 0.0 110.87 165.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.38 -38.59 74.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.936 0.895 . . . . 0.0 111.945 -178.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.84 -34.18 77.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.832 1.253 . . . . 0.0 112.339 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -93.0 -11.93 31.93 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 174.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.35 -54.14 13.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.084 1.311 . . . . 0.0 110.166 165.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -70.07 -22.19 63.08 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 175.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.96 -60.67 5.86 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.316 2.388 . . . . 0.0 114.418 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.75 60.82 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.568 1.184 . . . . 0.0 113.386 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.4 p -77.34 -13.6 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 171.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -161.88 97.54 0.15 Allowed Glycine 0 CA--C 1.533 1.177 0 CA-C-N 119.09 0.859 . . . . 0.0 114.57 171.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.2 m -81.31 77.22 8.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.593 1.957 . . . . 0.0 111.957 -176.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -154.84 130.37 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 126.551 1.94 . . . . 0.0 109.939 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -129.92 -14.25 4.0 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.445 1.498 . . . . 0.0 114.669 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 11.5 mt -92.82 109.84 41.66 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 124.819 1.248 . . . . 0.0 109.024 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -82.38 -4.99 11.82 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.961 3.107 . . . . 0.0 114.077 -178.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 t 56.46 51.55 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.629 1.572 . . . . 0.0 112.372 175.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.4 m -139.65 163.12 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 127.646 2.378 . . . . 0.0 109.481 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -81.32 -22.5 38.48 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -167.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.6 t -142.96 121.35 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.875 0.87 . . . . 0.0 110.874 172.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -162.58 -143.79 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.747 2.019 . . . . 0.0 108.933 173.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -76.01 -53.95 7.59 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 119.906 -1.746 . . . . 0.0 109.812 169.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.1 mt 66.53 162.29 0.13 Allowed Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.401 1.88 . . . . 0.0 114.502 169.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -60.96 167.55 8.67 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.344 2.696 . . . . 0.0 112.251 162.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.18 -25.89 58.61 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -170.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -115.7 97.23 0.78 Allowed Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.908 1.718 . . . . 0.0 110.984 172.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -153.52 -166.35 2.39 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.462 1.105 . . . . 0.0 111.568 -173.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -52.98 133.15 38.37 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.831 1.252 . . . . 0.0 113.301 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -161.09 143.37 12.33 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.831 1.252 . . . . 0.0 111.17 168.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 m . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.225 1.41 . . . . 0.0 111.855 171.641 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 8.2 tpt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -147.77 151.93 36.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.771 1.628 . . . . 0.0 111.16 170.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -103.64 152.63 21.55 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 10.5 p -128.72 163.51 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.891 2.076 . . . . 0.0 111.003 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 C--O 1.251 1.182 0 C-N-CA 125.231 1.412 . . . . 0.0 113.353 179.694 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -10.92 60.09 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -88.83 -36.7 15.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.115 1.366 . . . . 0.0 111.92 172.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -80.19 -24.28 40.41 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.42 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.5 -30.2 62.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.371 0.987 . . . . 0.0 112.791 175.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -73.38 -33.03 64.82 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.952 -1.093 . . . . 0.0 112.971 171.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.15 -36.72 83.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.505 0.722 . . . . 0.0 112.614 169.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.48 -44.54 93.03 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.376 -0.827 . . . . 0.0 110.544 168.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.11 -50.53 58.83 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.556 0.598 . . . . 0.0 113.384 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -61.49 -40.71 95.54 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 118.432 1.116 . . . . 0.0 112.011 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -64.14 -36.94 85.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.388 1.075 . . . . 0.0 112.383 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.5 mt -69.8 -39.02 76.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.341 1.057 . . . . 0.0 112.114 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 51.1 m-85 -61.49 -28.51 69.35 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 118.932 0.787 . . . . 0.0 112.533 167.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.8 -7.34 54.2 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -110.98 -31.32 7.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.953 1.301 . . . . 0.0 112.859 172.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.8 9.15 14.48 Favored Glycine 0 N--CA 1.476 1.31 0 C-N-CA 124.216 0.912 . . . . 0.0 114.474 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.84 54.87 3.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.994 1.717 . . . . 0.0 110.293 176.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -57.23 -34.51 68.65 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.008 0.923 . . . . 0.0 113.26 -171.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.23 -32.76 56.06 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.311 1.414 . . . . 0.0 111.845 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.92 -32.97 65.68 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 118.668 0.667 . . . . 0.0 111.969 168.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -67.45 -41.03 85.37 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.905 -1.122 . . . . 0.0 112.298 173.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.4 t -62.02 -39.74 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.545 1.138 . . . . 0.0 110.89 168.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -56.91 -32.47 65.96 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.314 0.961 . . . . 0.0 112.369 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.7 m -71.71 -39.74 69.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.259 -0.877 . . . . 0.0 113.295 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -38.71 75.05 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.301 1.409 . . . . 0.0 111.081 172.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -61.13 -32.17 71.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.107 1.363 . . . . 0.0 111.855 177.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -60.99 -40.08 92.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.671 1.123 . . . . 0.0 112.072 171.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.22 -42.8 88.2 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.774 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.1 mt -76.18 -22.52 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.123 0.969 . . . . 0.0 111.188 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 55.6 m -67.96 -41.92 81.68 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.891 -1.756 . . . . 0.0 111.222 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.32 -20.9 26.13 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.83 65.22 37.76 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.655 1.582 . . . . 0.0 110.809 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -61.93 -22.95 75.31 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.581 2.854 . . . . 0.0 117.27 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -123.33 10.68 9.28 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.42 1.488 . . . . 0.0 111.27 -170.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -90.64 131.77 36.94 Favored Pre-proline 0 CA--C 1.544 0.737 0 O-C-N 120.574 -1.329 . . . . 0.0 111.292 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.75 -17.46 60.01 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.683 2.255 . . . . 0.0 114.065 177.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.7 p -53.55 -42.67 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 119.028 0.831 . . . . 0.0 111.926 170.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.55 -37.97 85.81 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.18 -0.95 . . . . 0.0 111.624 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -69.84 -35.24 74.6 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.556 0.742 . . . . 0.0 112.64 175.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.6 t -61.26 -36.77 80.92 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.073 -1.017 . . . . 0.0 112.469 170.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -77.97 -28.49 49.43 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.513 0.725 . . . . 0.0 112.57 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -68.17 -41.94 80.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.873 1.215 . . . . 0.0 111.65 166.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.07 81.44 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.119 -0.988 . . . . 0.0 112.404 173.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -61.53 -49.41 76.82 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.269 1.028 . . . . 0.0 111.457 169.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.57 82.35 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.258 0.623 . . . . 0.0 112.221 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.3 mt -62.08 -42.85 99.63 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.894 0.878 . . . . 0.0 112.598 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.14 -20.73 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 119.55 1.068 . . . . 0.0 113.123 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.24 -8.27 56.99 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.604 1.162 . . . . 0.0 114.061 172.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.4 7.79 21.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.68 1.992 . . . . 0.0 112.735 170.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.16 17.98 79.65 Favored Glycine 0 CA--C 1.535 1.343 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 174.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -104.28 52.83 0.75 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.848 1.659 . . . . 0.0 110.75 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.64 -29.89 64.94 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.101 1.36 . . . . 0.0 112.683 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 m -62.99 -27.67 69.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.679 0.792 . . . . 0.0 112.506 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -77.02 -40.86 44.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.176 0.898 . . . . 0.0 111.299 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.09 93.22 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.385 -0.822 . . . . 0.0 113.005 -175.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.7 pt -63.88 -30.66 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -78.24 -45.56 22.61 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.6 171.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.9 ttm -65.13 -28.87 69.72 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.162 -0.961 . . . . 0.0 113.083 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.9 m -66.42 -39.93 89.25 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.99 -1.069 . . . . 0.0 112.295 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -62.71 -45.73 91.37 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.036 0.835 . . . . 0.0 110.391 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.99 -37.06 68.61 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.87 -23.65 59.32 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.224 1.375 . . . . 0.0 115.066 177.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.74 -18.93 65.68 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.57 1.685 . . . . 0.0 112.416 171.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -72.14 5.01 3.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.443 1.497 . . . . 0.0 114.829 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -121.35 44.18 2.61 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.475 1.91 . . . . 0.0 111.037 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.0 p -132.13 -2.19 3.6 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -164.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 81.6 p -63.93 -15.85 60.1 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 -164.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 p -120.17 165.97 14.06 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 120.586 1.539 . . . . 0.0 113.7 -173.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.82 -0.86 1.64 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.1 1.36 . . . . 0.0 114.594 174.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -83.32 -17.63 41.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.344 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -129.98 15.09 5.78 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.492 1.517 . . . . 0.0 114.203 -166.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.54 -30.34 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 120.494 -1.379 . . . . 0.0 112.32 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.55 -38.81 81.11 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.176 -0.953 . . . . 0.0 112.086 171.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.2 mm -61.56 -37.93 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.593 1.157 . . . . 0.0 110.687 174.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.09 -44.37 96.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.607 1.163 . . . . 0.0 112.619 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 t -63.78 -48.54 76.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 111.892 167.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.3 ttpt -58.0 -44.43 87.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 112.939 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.05 -24.47 51.98 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.779 1.172 . . . . 0.0 113.794 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.96 -34.2 59.81 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.278 1.399 . . . . 0.0 113.459 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -35.37 58.59 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.116 0.871 . . . . 0.0 111.647 168.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -57.76 -40.58 80.1 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.039 1.29 . . . . 0.0 111.659 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -65.69 -41.76 92.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.933 0.893 . . . . 0.0 112.874 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.817 0.847 . . . . 0.0 111.017 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.21 -20.03 35.37 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.77 -50.88 65.07 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.925 1.239 . . . . 0.0 110.329 164.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.86 -28.25 69.36 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.927 0.891 . . . . 0.0 111.964 171.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.24 -55.68 17.47 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 127.535 2.493 . . . . 0.0 112.591 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.69 76.52 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.986 1.714 . . . . 0.0 112.56 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.3 p . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 175.163 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.61 -30.88 66.29 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.103 -0.998 . . . . 0.0 112.527 177.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.45 -28.12 64.77 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.034 1.734 . . . . 0.0 112.48 165.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.34 -45.61 17.49 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.742 0.817 . . . . 0.0 112.9 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -66.28 -27.17 67.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.882 1.219 . . . . 0.0 112.858 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -64.01 -45.93 86.75 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.604 1.093 . . . . 0.0 111.571 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.77 -34.78 60.27 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 -39.8 71.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.958 1.254 . . . . 0.0 111.649 175.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.97 -35.26 91.77 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 120.925 -1.109 . . . . 0.0 112.714 170.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -62.23 -40.46 96.21 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.127 -1.219 . . . . 0.0 112.111 169.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.3 t -63.23 -35.85 81.69 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.513 -0.742 . . . . 0.0 112.151 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.4 mt -65.98 -36.93 84.65 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.606 -1.308 . . . . 0.0 112.482 172.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.73 -33.56 76.15 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.651 1.114 . . . . 0.0 112.228 167.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.9 -2.28 17.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.573 1.549 . . . . 0.0 114.598 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -113.28 -50.74 2.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.495 1.918 . . . . 0.0 112.35 175.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.3 0.23 3.41 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.863 1.22 . . . . 0.0 115.34 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -85.33 51.99 2.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.749 2.42 . . . . 0.0 111.319 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.88 -33.57 70.64 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.987 1.315 . . . . 0.0 113.15 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -68.7 -47.11 67.22 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.927 1.24 . . . . 0.0 110.351 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.41 -36.58 79.31 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.325 0.39 . . . . 0.0 111.41 176.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.16 77.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.318 0.647 . . . . 0.0 112.62 176.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.2 t -62.43 -37.28 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.674 0.79 . . . . 0.0 110.77 174.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -61.02 -39.2 88.85 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.037 0.835 . . . . 0.0 112.651 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -66.04 -40.96 91.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.44 0.696 . . . . 0.0 112.199 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -68.4 -37.31 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.609 -0.682 . . . . 0.0 112.485 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -63.56 -26.14 68.56 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -76.69 -26.89 55.24 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.746 1.157 . . . . 0.0 113.52 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -62.0 -31.2 71.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.096 0.862 . . . . 0.0 110.491 170.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.2 mt -79.75 -41.93 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 124.461 1.105 . . . . 0.0 111.652 173.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 52.3 m -52.51 -42.3 64.2 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.694 1.588 . . . . 0.0 112.057 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -24.59 53.88 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -140.42 57.43 8.68 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.179 1.392 . . . . 0.0 112.781 -169.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -64.31 -23.95 65.34 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.383 2.055 . . . . 0.0 115.731 -166.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -95.15 -14.07 24.48 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.535 1.134 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -88.12 128.16 54.68 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 119.141 0.882 . . . . 0.0 112.675 -172.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -60.88 -22.79 75.26 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.641 2.227 . . . . 0.0 114.05 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.7 -30.77 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.4 1.48 . . . . 0.0 113.607 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -35.58 55.53 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.36 -1.462 . . . . 0.0 112.136 174.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -79.72 -33.85 40.54 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.572 1.149 . . . . 0.0 112.489 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.9 p -62.49 -31.08 71.77 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.223 -0.923 . . . . 0.0 112.24 169.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -77.23 -47.04 21.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.41 1.084 . . . . 0.0 111.607 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -57.53 -35.56 70.45 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.879 1.672 . . . . 0.0 112.552 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.04 89.89 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 169.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 tpt -65.16 -43.25 92.39 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.636 1.175 . . . . 0.0 111.606 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.61 93.51 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.654 0.782 . . . . 0.0 112.368 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.9 mt -58.6 -41.32 85.55 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.217 0.607 . . . . 0.0 112.404 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.25 -33.14 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-N 118.961 0.8 . . . . 0.0 112.699 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -18.16 63.64 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.631 1.173 . . . . 0.0 113.197 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 tt -95.96 -39.6 9.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.345 2.258 . . . . 0.0 111.899 179.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 122.16 16.92 3.81 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.614 1.102 . . . . 0.0 115.715 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -103.02 48.4 0.86 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.746 1.619 . . . . 0.0 110.319 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -55.09 -38.1 67.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.665 1.586 . . . . 0.0 112.147 -174.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.6 m -65.97 -20.44 66.2 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 113.285 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -81.62 -40.26 23.23 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.874 -1.141 . . . . 0.0 110.978 169.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.95 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.5 pt -62.09 -33.04 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.742 0.701 . . . . 0.0 112.632 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.5 tm0? -75.83 -43.94 43.48 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.124 0.569 . . . . 0.0 111.669 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.9 tpp -54.76 -39.04 67.94 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.969 0.804 . . . . 0.0 112.568 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.36 -40.76 91.92 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.196 -0.94 . . . . 0.0 113.018 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -76.12 -28.48 57.48 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.27 1.028 . . . . 0.0 112.482 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -32.47 70.47 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.851 0.86 . . . . 0.0 112.245 166.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.57 -25.45 60.81 Favored Glycine 0 CA--C 1.536 1.364 0 O-C-N 120.321 -1.487 . . . . 0.0 113.942 174.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.86 -21.33 28.54 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.33 1.565 . . . . 0.0 112.958 166.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -72.31 4.23 3.9 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 125.556 1.542 . . . . 0.0 115.032 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -124.09 29.09 6.54 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.468 2.307 . . . . 0.0 111.947 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -127.0 12.12 7.16 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -163.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.1 p -71.55 -7.48 47.89 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -169.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.7 t -132.86 157.12 45.84 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.016 1.726 . . . . 0.0 112.135 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -48.65 -33.07 9.29 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.339 1.855 . . . . 0.0 112.84 173.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -55.94 -19.45 12.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.448 1.499 . . . . 0.0 114.065 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -131.79 17.07 4.73 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 112.453 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.5 p -71.96 -32.47 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 120.066 -1.646 . . . . 0.0 112.891 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.68 -35.32 70.24 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.239 -0.913 . . . . 0.0 111.405 171.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.1 mm -59.84 -37.37 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.988 1.715 . . . . 0.0 112.108 168.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -58.5 -33.61 70.01 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.401 1.0 . . . . 0.0 112.469 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -77.86 -41.59 36.29 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.699 0.8 . . . . 0.0 112.774 167.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -66.34 -16.99 64.5 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -92.83 -36.64 12.73 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.933 1.242 . . . . 0.0 114.051 161.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -73.1 -30.99 64.05 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.773 1.624 . . . . 0.0 113.727 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -31.17 63.89 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.592 1.087 . . . . 0.0 111.531 167.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -63.48 -34.13 77.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.121 -0.987 . . . . 0.0 111.807 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.74 -44.35 96.42 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.111 0.964 . . . . 0.0 112.079 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -68.7 -33.05 73.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.868 1.267 . . . . 0.0 111.943 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.36 -14.51 46.17 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 174.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.85 -46.27 65.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.905 1.684 . . . . 0.0 111.194 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -74.11 -6.49 47.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.75 -49.77 6.36 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.592 1.568 . . . . 0.0 113.66 162.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.89 -27.48 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.028 2.131 . . . . 0.0 113.69 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 124.357 1.063 . . . . 0.0 112.569 169.48 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.15 -38.65 72.23 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.47 -0.769 . . . . 0.0 112.9 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.58 -24.51 64.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.277 1.031 . . . . 0.0 113.379 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -73.53 -63.0 1.29 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.592 1.157 . . . . 0.0 111.378 160.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -60.83 -30.62 70.2 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -163.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -65.55 -37.42 86.65 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.101 0.96 . . . . 0.0 112.942 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -92.41 -31.33 15.34 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.558 1.072 . . . . 0.0 112.122 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -49.37 -39.56 32.56 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.313 1.445 . . . . 0.0 111.674 166.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -52.77 -43.2 60.13 Favored Glycine 0 CA--C 1.537 1.444 0 O-C-N 121.435 -0.791 . . . . 0.0 113.972 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -70.51 -38.78 74.33 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.199 1.499 . . . . 0.0 111.956 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -63.72 -31.94 73.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.278 1.031 . . . . 0.0 112.502 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.83 -37.59 79.26 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.587 -1.321 . . . . 0.0 112.332 175.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.48 -32.61 73.53 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.422 1.01 . . . . 0.0 112.245 165.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.0 10.8 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.53 1.932 . . . . 0.0 114.947 174.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -120.54 -44.55 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.781 1.633 . . . . 0.0 110.732 165.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.69 -1.68 3.61 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.19 1.376 . . . . 0.0 114.821 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.0 mt -87.26 53.56 2.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.466 1.906 . . . . 0.0 111.244 -170.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -53.71 -35.93 61.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.012 1.325 . . . . 0.0 113.36 -173.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -75.21 -33.65 61.4 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.188 0.904 . . . . 0.0 112.176 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -75.44 -29.76 59.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.167 0.894 . . . . 0.0 112.248 168.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.7 -44.55 89.88 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.127 -0.983 . . . . 0.0 111.861 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.9 t -62.83 -42.01 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.928 0.891 . . . . 0.0 111.02 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -54.28 -40.37 67.78 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.63 0.65 . . . . 0.0 112.717 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.9 m -68.97 -38.85 79.63 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.952 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.18 -35.68 76.54 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.512 1.506 . . . . 0.0 111.361 172.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.61 -22.3 65.36 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.291 1.036 . . . . 0.0 112.582 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.87 -47.92 73.29 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.904 0.775 . . . . 0.0 111.391 167.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -36.76 76.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.123 0.874 . . . . 0.0 110.619 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 55.7 mt -74.55 -21.92 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.024 0.829 . . . . 0.0 112.277 177.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.2 m -79.18 -41.66 27.87 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.431 -1.418 . . . . 0.0 111.85 171.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.19 -25.16 29.74 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -137.99 63.95 39.55 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 125.475 1.51 . . . . 0.0 111.189 -175.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -64.07 -12.1 30.67 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.76 2.973 . . . . 0.0 118.567 -165.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -122.08 3.98 9.86 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.037 0.935 . . . . 0.0 112.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.0 123.34 82.15 Favored Pre-proline 0 CA--C 1.544 0.742 0 O-C-N 120.391 -1.443 . . . . 0.0 110.329 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -63.43 -11.34 25.34 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.364 2.043 . . . . 0.0 114.461 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -53.61 -36.2 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.034 0.834 . . . . 0.0 112.42 167.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.9 -50.86 16.86 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 121.485 -0.76 . . . . 0.0 112.351 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -61.65 -40.96 96.76 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.022 0.929 . . . . 0.0 112.587 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.6 p -70.24 -21.64 62.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.091 -1.006 . . . . 0.0 113.615 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.74 -46.27 19.29 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.684 0.794 . . . . 0.0 111.412 170.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.28 -41.35 84.15 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.969 0.907 . . . . 0.0 112.568 173.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.82 -32.0 70.24 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -68.93 -44.56 72.82 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.627 -0.67 . . . . 0.0 111.127 172.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.18 82.49 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.757 0.823 . . . . 0.0 112.818 177.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.09 -47.0 81.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.364 0.666 . . . . 0.0 111.582 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.59 -29.48 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.487 1.04 . . . . 0.0 112.991 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.21 0.23 33.35 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.33 12.32 7.01 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.636 1.974 . . . . 0.0 113.687 171.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.39 15.79 79.31 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.494 1.357 . . . . 0.0 116.494 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -91.9 44.47 1.17 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.827 1.651 . . . . 0.0 112.452 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.0 -37.3 68.95 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.36 1.064 . . . . 0.0 113.03 -175.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 62.4 m -62.46 -30.06 70.98 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.88 1.272 . . . . 0.0 112.52 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -87.38 -29.32 21.6 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.001 0.52 . . . . 0.0 111.149 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.29 -41.4 73.4 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.306 1.042 . . . . 0.0 113.059 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.8 pt -60.64 -34.45 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.138 0.881 . . . . 0.0 112.029 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -68.43 -51.49 43.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.587 0.755 . . . . 0.0 111.373 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.88 -29.29 70.49 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -66.65 -43.59 84.2 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.044 -1.035 . . . . 0.0 111.998 174.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -67.99 -36.95 80.87 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.724 0.693 . . . . 0.0 111.563 175.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.62 -32.88 73.04 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.3 -0.875 . . . . 0.0 112.845 168.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.09 -23.33 66.43 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.493 -1.38 . . . . 0.0 114.402 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.47 -20.02 65.94 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.499 1.65 . . . . 0.0 112.944 171.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -65.92 -5.45 9.34 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.529 1.532 . . . . 0.0 114.58 169.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -122.37 50.25 1.5 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.913 2.085 . . . . 0.0 110.664 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -136.17 4.27 2.94 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -67.09 -29.98 69.9 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -164.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.2 p -113.1 166.27 11.58 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.115 1.366 . . . . 0.0 112.668 -169.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.01 -30.83 64.53 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.06 16.42 0.16 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -133.18 10.26 4.14 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.485 1.514 . . . . 0.0 113.577 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.4 m -63.77 -30.26 49.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 O-C-N 120.503 -1.373 . . . . 0.0 114.123 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.9 -37.23 24.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.734 0.697 . . . . 0.0 111.24 173.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -55.29 -43.98 73.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.336 1.055 . . . . 0.0 111.293 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 49.8 ttp85 -60.32 -40.12 89.45 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.082 0.953 . . . . 0.0 112.046 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -66.75 -46.54 75.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.04 0.936 . . . . 0.0 112.678 170.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -51.73 -57.52 9.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.171 0.896 . . . . 0.0 111.394 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -67.22 -28.24 67.91 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.825 1.193 . . . . 0.0 113.562 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -74.3 -45.89 44.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.848 1.204 . . . . 0.0 112.81 174.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -33.21 73.06 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.039 1.29 . . . . 0.0 111.646 176.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.9 mmt-85 -55.65 -36.96 67.61 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.42 1.009 . . . . 0.0 112.064 171.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 20.1 tp -70.01 -44.14 69.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.142 0.883 . . . . 0.0 111.92 178.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -63.96 -30.29 71.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.047 0.939 . . . . 0.0 112.983 172.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.89 -20.22 23.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.56 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.778 1.626 . . . . 0.0 110.327 168.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -69.56 -16.67 63.46 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 171.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.71 -52.22 7.39 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 125.627 1.584 . . . . 0.0 113.382 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.4 -36.41 66.02 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.598 1.559 . . . . 0.0 112.444 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.479 0.982 0 C-N-CA 123.353 0.661 . . . . 0.0 112.212 174.579 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -15.49 49.33 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -74.17 -52.19 13.24 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 157.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.08 -39.8 60.27 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.265 1.026 . . . . 0.0 112.5 -176.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -72.27 -28.34 63.05 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -81.79 -34.65 30.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.218 1.372 . . . . 0.0 112.708 173.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -75.94 -41.06 52.77 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.123 0.969 . . . . 0.0 111.222 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -59.82 -39.4 84.93 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.867 0.867 . . . . 0.0 111.275 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.18 -50.62 51.11 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-N 119.108 0.867 . . . . 0.0 112.477 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -66.24 -40.81 90.5 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.315 1.057 . . . . 0.0 111.601 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 t -57.52 -43.11 84.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.421 1.088 . . . . 0.0 112.668 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.7 mt -67.2 -35.61 79.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.92 1.288 . . . . 0.0 112.142 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -70.3 -28.13 64.94 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 172.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.86 -14.34 61.47 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.283 1.033 . . . . 0.0 112.79 171.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -98.63 -53.87 3.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.873 1.269 . . . . 0.0 112.793 176.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.65 14.95 0.99 Allowed Glycine 0 CA--C 1.537 1.46 0 N-CA-C 115.364 0.906 . . . . 0.0 115.364 -172.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.0 mt -101.61 58.01 0.85 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.285 1.834 . . . . 0.0 110.21 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.99 -36.82 85.24 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.8 1.24 . . . . 0.0 113.499 -168.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.63 -33.19 27.95 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.227 0.921 . . . . 0.0 111.279 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -63.49 -39.99 95.89 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.15 0.432 . . . . 0.0 110.558 167.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.55 -45.88 77.95 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.491 -0.755 . . . . 0.0 112.757 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.06 -35.43 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.199 173.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -61.12 -44.75 96.85 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.857 1.208 . . . . 0.0 112.166 172.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.0 m -60.14 -39.94 88.11 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.841 0.856 . . . . 0.0 112.674 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -75.0 -38.14 61.68 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 175.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -62.49 -32.21 73.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.264 0.938 . . . . 0.0 111.452 172.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -69.36 -26.73 64.82 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 174.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.49 -42.6 78.59 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.988 1.267 . . . . 0.0 110.552 166.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.6 mt -80.93 -21.39 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.022 1.329 . . . . 0.0 111.642 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.1 m -66.29 -44.38 83.67 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.241 -1.537 . . . . 0.0 110.735 168.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.77 -19.9 31.88 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.867 1.267 . . . . 0.0 114.355 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -141.45 68.6 26.05 Favored Pre-proline 0 CA--C 1.556 1.181 0 C-N-CA 125.49 1.516 . . . . 0.0 111.143 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -67.18 -22.01 47.55 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.866 2.378 . . . . 0.0 117.037 -167.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.2 tp60 -100.18 -27.12 13.68 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.616 1.166 . . . . 0.0 111.794 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -69.51 138.18 88.68 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 123.865 0.866 . . . . 0.0 112.872 -171.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.28 -20.83 62.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.909 2.406 . . . . 0.0 113.935 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -46.22 -59.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 125.244 1.418 . . . . 0.0 112.222 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.51 -34.86 85.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 118.95 -0.917 . . . . 0.0 113.432 -172.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -62.62 -42.4 99.57 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.897 1.349 . . . . 0.0 111.285 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.7 p -67.06 -25.44 66.25 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -85.19 -38.82 18.53 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.931 0.892 . . . . 0.0 112.056 172.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -63.32 -31.29 72.4 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.1 -1.625 . . . . 0.0 112.173 173.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.26 -38.61 84.04 Favored 'General case' 0 CA--C 1.548 0.904 0 O-C-N 121.007 -1.058 . . . . 0.0 113.364 169.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -64.12 -43.46 95.2 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.74 0.816 . . . . 0.0 111.17 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.96 79.43 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.334 0.654 . . . . 0.0 111.878 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.75 -38.93 92.49 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.503 -0.748 . . . . 0.0 112.751 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.4 pt -75.79 -25.86 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 CA-C-N 120.111 1.323 . . . . 0.0 113.831 174.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -19.96 39.11 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.913 1.285 . . . . 0.0 113.143 175.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 tt -80.41 -43.52 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.687 1.595 . . . . 0.0 109.854 165.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.79 32.36 4.47 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.242 0.925 . . . . 0.0 113.802 -175.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -101.71 57.42 0.83 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.761 1.624 . . . . 0.0 109.232 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -59.33 -35.05 73.11 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.494 -0.754 . . . . 0.0 111.917 -170.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 88.4 m -62.08 -29.91 70.64 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.114 0.966 . . . . 0.0 112.785 174.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -81.57 -34.54 31.01 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 111.453 171.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.36 98.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.24 -0.913 . . . . 0.0 112.881 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.9 pt -64.33 -30.44 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.299 0.639 . . . . 0.0 112.681 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -71.08 -51.21 26.52 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.475 0.71 . . . . 0.0 110.767 170.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.6 ttm -63.51 -34.04 76.9 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -175.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.3 m -69.76 -42.64 73.58 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.17 -0.956 . . . . 0.0 112.053 175.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.17 -37.16 80.68 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.011 0.823 . . . . 0.0 112.078 177.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -39.92 92.53 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.332 1.053 . . . . 0.0 111.867 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.41 -23.92 77.49 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.229 -1.544 . . . . 0.0 114.233 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.2 mt -66.93 -25.75 66.51 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.959 1.379 . . . . 0.0 112.348 169.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.78 -48.34 82.06 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.142 0.883 . . . . 0.0 111.24 170.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -64.24 -28.1 69.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.255 1.022 . . . . 0.0 113.351 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.5 p -118.64 -1.4 11.15 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -158.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -78.68 49.79 0.92 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.579 1.152 . . . . 0.0 112.825 177.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 t -157.46 153.46 27.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.622 1.569 . . . . 0.0 112.025 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.06 -35.59 25.8 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -164.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.52 -2.82 47.67 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -133.62 12.26 4.08 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.957 1.703 . . . . 0.0 113.098 -173.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.49 -24.86 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.74 -37.22 59.53 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.427 1.012 . . . . 0.0 111.133 171.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mm -65.6 -33.86 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.284 1.033 . . . . 0.0 111.186 173.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -57.41 -44.5 84.65 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.909 1.284 . . . . 0.0 111.401 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 m -66.55 -34.5 78.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.923 0.889 . . . . 0.0 112.56 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -68.9 -0.6 5.75 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 170.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.98 -33.39 6.93 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 117.522 -1.228 . . . . 0.0 113.405 156.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -54.6 -54.64 38.69 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.238 1.835 . . . . 0.0 112.092 173.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -30.17 67.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 122.08 -0.388 . . . . 0.0 111.452 -172.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -64.83 -40.3 94.96 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.35 -0.844 . . . . 0.0 111.563 170.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.57 -30.75 68.61 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.968 0.907 . . . . 0.0 112.159 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -68.69 -47.45 66.41 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.006 0.523 . . . . 0.0 112.063 165.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.88 -16.09 62.67 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.095 -1.003 . . . . 0.0 113.694 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.46 93.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.437 1.471 . . . . 0.0 111.327 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.58 -27.47 65.14 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 121.47 0.652 . . . . 0.0 112.038 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.67 -47.15 42.61 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.349 1.452 . . . . 0.0 112.782 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.17 -32.68 44.3 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.02 1.728 . . . . 0.0 113.218 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.478 0.96 0 CA-C-N 118.953 0.797 . . . . 0.0 111.112 170.791 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -13.2 59.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 174.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -77.81 -48.33 16.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 120.96 -1.087 . . . . 0.0 108.636 163.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -46.74 65.04 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.256 1.022 . . . . 0.0 111.974 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -66.92 -25.96 66.62 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.5 ptpp? -86.95 -30.97 20.91 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.987 1.267 . . . . 0.0 113.589 174.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -76.92 -31.85 56.95 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.968 0.803 . . . . 0.0 111.185 173.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -57.66 -52.62 64.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.624 1.57 . . . . 0.0 110.776 159.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.13 -45.97 71.59 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.175 0.898 . . . . 0.0 113.746 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -52.09 66.47 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.936 1.294 . . . . 0.0 111.479 173.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.4 m -60.15 -47.88 84.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.9 0.88 . . . . 0.0 111.379 -178.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -55.71 -35.65 66.32 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.727 1.211 . . . . 0.0 112.044 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -66.48 -41.66 88.64 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 120.069 1.304 . . . . 0.0 113.997 173.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -42.19 99.37 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 119.262 0.937 . . . . 0.0 111.833 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -72.35 -25.16 61.43 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.85 12.88 15.08 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.263 1.411 . . . . 0.0 116.055 171.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.2 mt -97.81 61.8 1.59 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.93 2.092 . . . . 0.0 111.047 -174.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -59.26 -30.52 68.35 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.642 1.177 . . . . 0.0 113.986 -175.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -84.31 -32.24 24.44 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.015 -1.053 . . . . 0.0 111.463 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -65.61 -42.79 91.21 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.821 164.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.08 -48.49 70.8 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.479 -0.763 . . . . 0.0 112.405 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 49.6 t -60.34 -33.48 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.574 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -59.68 -43.69 93.9 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.026 1.285 . . . . 0.0 112.592 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.3 m -70.3 -34.03 72.24 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.721 -0.612 . . . . 0.0 112.313 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -72.89 -40.2 65.75 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.877 0.871 . . . . 0.0 112.901 172.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -58.76 -36.06 73.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.546 1.138 . . . . 0.0 111.263 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.33 -14.45 60.1 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.67 -39.98 95.68 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.13 1.332 . . . . 0.0 110.251 161.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.9 mt -75.56 -44.59 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 m -60.1 -33.47 72.15 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.771 1.169 . . . . 0.0 112.286 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.39 -22.09 44.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -144.55 61.12 8.28 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.085 1.354 . . . . 0.0 111.802 -170.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -64.99 -20.52 64.05 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.353 2.035 . . . . 0.0 117.164 -158.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -113.27 3.26 15.88 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.074 0.95 . . . . 0.0 112.237 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -82.01 127.12 73.11 Favored Pre-proline 0 CA--C 1.541 0.608 0 O-C-N 120.717 -1.239 . . . . 0.0 111.613 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.39 -14.79 44.38 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 122.347 2.031 . . . . 0.0 113.806 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.58 -36.98 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-N 119.739 1.154 . . . . 0.0 112.287 170.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.38 -50.16 28.22 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 121.099 -1.0 . . . . 0.0 111.717 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -66.73 -38.56 86.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.303 1.041 . . . . 0.0 112.967 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.7 p -69.58 -14.46 62.85 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 173.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -91.81 -41.4 10.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.276 1.031 . . . . 0.0 111.946 168.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.37 -36.77 83.3 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.793 -1.192 . . . . 0.0 112.396 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.76 -35.3 76.05 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.327 -0.858 . . . . 0.0 113.021 170.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.6 tpt -68.85 -41.87 77.88 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.828 0.851 . . . . 0.0 111.657 175.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -46.11 84.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.746 0.819 . . . . 0.0 111.286 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.6 mt -59.57 -35.82 75.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.66 0.784 . . . . 0.0 112.951 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.5 pt -84.07 -17.78 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.01 -14.92 53.05 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.674 1.19 . . . . 0.0 112.429 168.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.5 tt -94.3 -50.61 5.18 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.924 2.489 . . . . 0.0 111.579 175.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.88 15.95 2.51 Favored Glycine 0 CA--C 1.54 1.646 0 N-CA-C 116.4 1.32 . . . . 0.0 116.4 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -105.31 53.69 0.71 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.413 1.485 . . . . 0.0 110.002 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.87 -29.55 69.61 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.032 -1.042 . . . . 0.0 112.998 -173.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.5 m -60.74 -29.8 69.6 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.953 0.797 . . . . 0.0 111.912 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -76.36 -36.33 58.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.106 0.562 . . . . 0.0 111.445 172.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.32 -37.93 74.83 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.8 pt -65.08 -33.32 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.896 0.771 . . . . 0.0 111.973 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.0 tm0? -68.6 -45.8 71.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.45 0.7 . . . . 0.0 110.818 171.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.9 ttm -73.77 -31.2 63.18 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -173.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.9 m -66.76 -39.91 88.04 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.907 -1.121 . . . . 0.0 111.464 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -67.48 -37.66 83.23 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.442 -0.786 . . . . 0.0 112.008 173.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.32 -31.93 72.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.284 0.634 . . . . 0.0 111.989 171.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.93 -24.56 64.06 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 120.241 1.382 . . . . 0.0 114.391 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.4 mt -62.3 -22.16 65.82 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.648 1.724 . . . . 0.0 112.253 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.68 -2.44 2.45 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 169.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -120.81 40.59 3.5 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.052 1.741 . . . . 0.0 111.665 -175.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 34.3 p -135.9 7.44 3.21 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 116.857 2.169 . . . . 0.0 116.857 -164.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 95.3 p -83.38 19.05 1.62 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -172.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -142.81 144.62 32.63 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.609 1.964 . . . . 0.0 109.61 177.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.79 -9.79 31.65 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.031 0.932 . . . . 0.0 113.465 176.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -59.12 -23.69 62.34 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.399 1.08 . . . . 0.0 112.309 164.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -129.92 24.22 5.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.937 2.095 . . . . 0.0 112.675 -176.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.06 -34.46 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 O-C-N 119.958 -1.714 . . . . 0.0 111.996 173.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.0 79.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.521 -0.737 . . . . 0.0 111.44 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.1 mm -65.13 -37.11 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.43 1.092 . . . . 0.0 111.184 170.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -59.57 -40.21 86.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.702 0.801 . . . . 0.0 111.997 177.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.6 t -70.04 -46.49 64.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.218 1.007 . . . . 0.0 112.162 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -72.05 -3.95 25.94 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -175.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -101.58 -33.13 10.04 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.064 1.302 . . . . 0.0 113.705 158.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -67.75 -49.71 61.04 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 120.381 1.446 . . . . 0.0 112.723 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -34.17 77.31 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.878 1.217 . . . . 0.0 111.19 174.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -65.04 -31.65 72.99 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.86 -1.15 . . . . 0.0 112.116 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.9 tp -71.63 -37.96 70.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.299 1.04 . . . . 0.0 112.774 169.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.03 -36.92 83.05 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.757 -0.589 . . . . 0.0 111.438 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.56 -25.49 35.8 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.889 -1.132 . . . . 0.0 113.259 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.72 99.89 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.47 1.486 . . . . 0.0 111.408 167.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -64.63 -27.18 68.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.801 0.84 . . . . 0.0 112.211 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.52 -46.04 57.09 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 125.688 1.613 . . . . 0.0 113.605 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.64 -28.79 61.02 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.6 1.16 . . . . 0.0 113.094 -177.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.7 p . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 178.977 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 119.698 -0.191 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -63.7 -37.22 86.53 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.425 -0.797 . . . . 0.0 112.835 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -72.21 -17.76 61.9 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.18 -28.32 16.35 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.3 -36.23 68.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.471 1.032 . . . . 0.0 112.512 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -60.1 -33.67 72.43 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.072 0.851 . . . . 0.0 111.344 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.62 -34.02 62.7 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.678 0.791 . . . . 0.0 113.041 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -64.74 -42.83 94.88 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.316 -0.865 . . . . 0.0 111.435 168.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.87 -41.83 99.39 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 121.669 -0.644 . . . . 0.0 112.482 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -58.74 -38.43 78.39 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.784 -0.833 . . . . 0.0 112.544 172.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -68.83 -42.46 77.17 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.683 0.674 . . . . 0.0 111.901 175.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -56.76 -40.45 75.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.868 1.213 . . . . 0.0 112.438 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.428 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 35.4 m-85 -58.14 -39.07 77.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.857 0.753 . . . . 0.0 112.322 171.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.56 65.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -84.86 4.46 33.13 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.226 0.921 . . . . 0.0 113.157 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.75 4.57 90.01 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-O 119.142 -0.81 . . . . 0.0 114.151 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.8 mt -84.62 54.04 2.89 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.313 1.557 . . . . 0.0 111.622 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -57.35 -32.25 66.56 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.897 1.279 . . . . 0.0 113.306 -173.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -83.59 -23.95 31.71 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.336 1.426 . . . . 0.0 113.039 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -75.76 -36.8 59.75 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.277 0.944 . . . . 0.0 111.21 164.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.428 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -75.76 -38.1 58.66 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.428 HG13 ' CE2' ' A' ' 27' ' ' TYR . 33.0 t -64.88 -35.56 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 O-C-N 120.626 -1.296 . . . . 0.0 110.885 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -59.88 -33.36 71.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.032 0.833 . . . . 0.0 112.267 171.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.6 m -64.64 -36.19 83.46 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.465 173.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.428 ' CE2' HG13 ' A' ' 24' ' ' VAL 0.336 0.2 OUTLIER -66.11 -29.82 70.2 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.491 1.496 . . . . 0.0 114.249 -178.826 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.59 -36.12 80.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.317 0.962 . . . . 0.0 112.096 172.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -61.62 -34.15 75.15 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.763 0.711 . . . . 0.0 112.659 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.41 -37.08 85.88 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 121.711 -0.618 . . . . 0.0 110.873 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.7 mt -82.18 -35.81 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 110.444 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.8 m -63.37 -31.66 72.88 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.4 1.454 . . . . 0.0 112.628 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.13 -29.37 57.79 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 169.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -134.65 61.81 50.59 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 124.838 1.255 . . . . 0.0 112.286 -169.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -64.04 -25.4 66.27 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.601 2.201 . . . . 0.0 117.279 -160.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -120.06 23.34 11.05 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.538 1.135 . . . . 0.0 111.728 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -106.44 123.29 39.28 Favored Pre-proline 0 CA--C 1.544 0.734 0 O-C-N 121.182 -0.949 . . . . 0.0 112.824 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.97 -13.64 24.03 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.116 2.544 . . . . 0.0 115.983 174.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.16 -37.77 57.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 120.262 1.392 . . . . 0.0 112.663 166.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.17 -44.49 60.04 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.647 0.658 . . . . 0.0 111.573 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -65.32 -37.73 88.0 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.874 -0.78 . . . . 0.0 111.628 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 37.3 m -59.99 -37.55 80.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.455 1.102 . . . . 0.0 111.884 171.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -81.47 -24.99 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.84 -40.82 92.1 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.971 -1.081 . . . . 0.0 111.614 163.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.25 -38.95 93.15 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.107 0.867 . . . . 0.0 112.596 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.1 tpt -60.41 -43.11 97.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.635 1.174 . . . . 0.0 112.043 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.21 -44.05 95.46 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.561 1.073 . . . . 0.0 112.417 172.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.5 mt -61.39 -44.57 96.92 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.536 0.734 . . . . 0.0 112.419 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -70.27 -29.0 37.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 119.432 1.014 . . . . 0.0 112.716 175.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -10.76 59.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -7.06 23.41 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.798 2.039 . . . . 0.0 112.55 167.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.21 14.21 75.01 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.7 1.143 . . . . 0.0 115.767 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -90.15 51.16 1.98 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.389 1.476 . . . . 0.0 110.769 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -55.35 -37.4 67.44 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.086 1.354 . . . . 0.0 112.467 -173.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.4 m -65.03 -22.84 67.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.993 1.317 . . . . 0.0 113.546 177.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -81.23 -39.5 25.26 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 110.769 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -37.41 87.04 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.596 -0.69 . . . . 0.0 112.707 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.0 pt -63.07 -33.17 59.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 113.127 177.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -72.68 -47.9 43.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.626 0.648 . . . . 0.0 110.969 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 29.0 ttm -63.58 -31.88 73.18 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 82.9 m -69.18 -39.93 78.42 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.121 -0.987 . . . . 0.0 111.798 174.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -69.4 -36.26 76.58 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.449 -0.782 . . . . 0.0 111.256 174.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -30.74 69.06 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.724 -1.235 . . . . 0.0 112.701 167.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.18 -31.69 54.38 Favored Glycine 0 N--CA 1.47 0.913 0 CA-C-N 120.612 1.551 . . . . 0.0 113.573 171.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.54 -28.92 70.27 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.34 1.57 . . . . 0.0 112.325 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -58.3 -16.04 12.65 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -88.65 2.8 52.55 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.223 1.409 . . . . 0.0 113.424 173.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -114.27 80.27 1.37 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -167.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.1 m -134.64 7.07 3.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.943 1.297 . . . . 0.0 114.151 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -143.02 161.13 38.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.389 1.475 . . . . 0.0 112.197 -173.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.0 -5.92 29.79 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -164.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.25 9.71 42.35 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 120.581 -1.324 . . . . 0.0 114.419 173.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -135.96 11.33 3.35 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.1 m -70.13 -35.57 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 120.183 -1.573 . . . . 0.0 114.236 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.47 -29.39 46.8 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.975 -1.078 . . . . 0.0 111.457 171.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.5 mm -58.33 -35.03 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 121.515 -0.741 . . . . 0.0 111.447 165.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttt-85 -57.39 -46.74 83.12 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.441 1.019 . . . . 0.0 110.715 173.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 75.3 m -64.69 -37.31 87.13 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.407 1.083 . . . . 0.0 113.591 171.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -57.18 -48.99 77.37 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.275 0.943 . . . . 0.0 110.842 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.93 -25.59 56.11 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 117.303 -1.332 . . . . 0.0 113.775 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -58.06 -53.8 54.16 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 120.855 1.662 . . . . 0.0 110.41 166.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -30.03 60.78 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -58.42 -37.42 75.33 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.812 1.187 . . . . 0.0 112.103 169.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.92 -39.99 69.08 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.827 0.739 . . . . 0.0 112.098 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -58.02 -39.88 79.45 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.548 -0.72 . . . . 0.0 112.167 169.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.2 -19.46 33.98 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 120.965 -1.084 . . . . 0.0 113.771 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.42 -37.54 77.49 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.488 1.495 . . . . 0.0 111.373 164.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -69.11 -29.4 67.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.951 0.9 . . . . 0.0 111.826 169.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -55.3 13.84 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 126.374 1.94 . . . . 0.0 112.107 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.65 -27.72 65.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.123 1.369 . . . . 0.0 113.637 -174.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 N--CA 1.482 1.172 0 CA-C-N 119.056 0.844 . . . . 0.0 112.61 172.79 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.218 0.532 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -40.91 91.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.358 1.063 . . . . 0.0 111.358 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.2 -25.44 67.04 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.172 1.389 . . . . 0.0 113.161 171.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.7 -47.62 18.7 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.129 0.972 . . . . 0.0 111.49 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.66 -31.7 68.72 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -58.58 -35.02 71.73 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.298 0.954 . . . . 0.0 112.991 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.56 -21.25 20.19 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.68 -42.12 98.5 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.561 171.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.84 -36.96 91.73 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-O 119.218 -0.768 . . . . 0.0 114.224 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -57.15 -46.34 82.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.857 1.329 . . . . 0.0 111.989 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -67.54 -43.42 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.153 0.981 . . . . 0.0 111.748 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.21 -42.95 87.32 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.443 -0.786 . . . . 0.0 111.736 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.07 -40.0 83.84 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.918 -1.114 . . . . 0.0 112.447 170.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -33.91 77.04 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.45 1.1 . . . . 0.0 113.659 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.48 -9.49 59.62 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 18.72 55.46 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.046 -1.033 . . . . 0.0 114.621 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 mt -93.28 55.0 2.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.178 2.191 . . . . 0.0 110.002 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 -61.5 -38.89 88.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -167.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.28 -38.47 65.89 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.145 0.884 . . . . 0.0 110.917 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -66.02 -34.86 79.04 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 122.974 0.509 . . . . 0.0 111.967 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.39 -53.15 53.04 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.952 0.501 . . . . 0.0 111.986 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.2 t -63.26 -32.34 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.665 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -53.82 -51.47 63.43 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.175 0.898 . . . . 0.0 111.416 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 99.7 m -57.89 -40.2 79.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.083 0.953 . . . . 0.0 112.204 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.415 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 76.8 m-85 -70.47 -41.25 73.0 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.717 0.689 . . . . 0.0 112.659 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -67.34 -25.52 66.04 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.896 0.771 . . . . 0.0 112.492 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -65.38 -32.0 73.4 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.342 -1.474 . . . . 0.0 111.767 169.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -68.03 -38.75 82.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.075 0.852 . . . . 0.0 110.919 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.9 mm -68.29 -37.23 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.697 0.799 . . . . 0.0 110.595 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.1 m -59.93 -32.49 70.83 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.951 1.3 . . . . 0.0 112.708 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.41 -16.85 20.99 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -138.36 51.56 3.91 Favored Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 123.958 0.903 . . . . 0.0 112.707 -166.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -61.62 -27.09 81.08 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.383 2.055 . . . . 0.0 116.803 -159.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -102.38 0.5 34.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -83.11 118.85 72.94 Favored Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.028 -1.045 . . . . 0.0 112.361 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -54.34 -25.42 39.1 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.079 2.519 . . . . 0.0 114.852 174.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -52.48 -44.61 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.058 0.943 . . . . 0.0 112.376 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -44.83 60.83 Favored Glycine 0 CA--C 1.528 0.876 0 O-C-N 121.56 -0.713 . . . . 0.0 112.359 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -60.78 -33.73 73.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.465 0.706 . . . . 0.0 111.859 173.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.0 t -68.43 -41.63 80.07 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.264 -0.897 . . . . 0.0 113.092 172.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -64.87 -35.37 80.92 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 118.676 0.671 . . . . 0.0 111.294 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -73.37 -31.65 64.05 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.785 -1.197 . . . . 0.0 112.767 175.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.28 93.93 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.868 -1.145 . . . . 0.0 112.224 168.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 43.4 tpp -59.0 -40.5 85.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.051 0.941 . . . . 0.0 111.609 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.89 -45.68 91.74 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.516 -0.74 . . . . 0.0 112.776 174.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.9 mt -66.14 -36.35 82.89 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.531 -0.731 . . . . 0.0 112.691 -176.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.6 pt -71.61 -28.8 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.737 1.153 . . . . 0.0 112.966 171.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.34 -20.85 36.49 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 tt -81.16 -32.82 33.49 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.286 1.434 . . . . 0.0 110.528 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.45 21.0 10.22 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.26 1.41 . . . . 0.0 114.842 175.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -96.11 57.86 1.79 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.875 1.338 . . . . 0.0 110.058 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -54.55 -37.86 65.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.854 1.262 . . . . 0.0 112.603 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.72 -23.28 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.245 1.018 . . . . 0.0 112.566 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -87.84 -31.72 19.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.826 0.85 . . . . 0.0 111.884 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -40.3 88.14 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.624 0.769 . . . . 0.0 112.162 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.454 HG22 HD12 ' A' ' 84' ' ' LEU . 34.1 pt -62.2 -38.96 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 118.828 0.74 . . . . 0.0 112.011 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.83 -44.69 92.45 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.688 0.795 . . . . 0.0 111.177 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.5 ttm -65.23 -31.35 72.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.784 0.72 . . . . 0.0 112.928 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.2 m -69.45 -42.82 74.41 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.994 -1.066 . . . . 0.0 111.817 174.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -62.11 -41.53 98.32 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.723 0.692 . . . . 0.0 111.947 172.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -34.95 77.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.453 1.101 . . . . 0.0 111.797 172.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.38 -30.33 56.91 Favored Glycine 0 CA--C 1.532 1.107 0 O-C-N 120.651 -1.28 . . . . 0.0 114.393 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.59 -30.02 68.38 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.58 1.69 . . . . 0.0 111.949 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -63.85 -16.7 61.96 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -92.57 34.71 1.05 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.164 1.385 . . . . 0.0 113.045 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.9 p -144.21 137.78 27.6 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 120.511 -1.368 . . . . 0.0 114.055 -166.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.7 t -163.73 -50.34 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 163.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -85.47 175.73 8.66 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.714 0.806 . . . . 0.0 112.895 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.01 -10.62 51.73 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -170.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -2.03 42.59 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.081 -1.012 . . . . 0.0 113.394 167.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -120.65 -9.46 9.36 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.285 1.434 . . . . 0.0 114.436 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -68.59 -31.21 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 O-C-N 119.845 -1.784 . . . . 0.0 113.535 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.02 -37.67 64.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.19 0.904 . . . . 0.0 111.649 165.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -57.08 -32.91 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.376 -0.828 . . . . 0.0 112.979 175.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.3 mtm180 -61.79 -44.74 96.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.191 0.996 . . . . 0.0 112.006 174.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.3 t -65.66 -38.78 90.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 118.747 0.703 . . . . 0.0 111.485 169.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -73.0 7.26 2.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.42 1.488 . . . . 0.0 114.367 176.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -114.83 -33.25 5.53 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.527 1.058 . . . . 0.0 112.629 153.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -68.13 -41.29 81.9 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 120.455 1.48 . . . . 0.0 114.116 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.59 78.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.434 -1.417 . . . . 0.0 111.191 173.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -60.93 -37.02 80.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.488 -0.758 . . . . 0.0 111.122 174.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.454 HD12 HG22 ' A' ' 58' ' ' ILE . 38.3 tp -70.21 -40.87 74.31 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.067 1.347 . . . . 0.0 112.441 174.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.99 -31.31 72.45 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.39 -0.819 . . . . 0.0 112.609 171.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -88.35 -22.84 23.6 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.25 95.86 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.596 1.544 . . . . 0.0 110.183 165.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -71.59 -31.91 67.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.477 1.111 . . . . 0.0 112.146 173.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.61 -47.18 63.47 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.26 1.409 . . . . 0.0 113.545 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.33 -26.29 60.06 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.261 1.424 . . . . 0.0 113.12 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.4 p . . . . . 0 N--CA 1.476 0.842 0 CA-C-N 119.022 0.828 . . . . 0.0 112.481 173.969 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 CA--C 1.54 0.571 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -92.66 -0.12 57.34 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 175.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -97.12 -37.95 9.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.212 1.805 . . . . 0.0 111.582 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -39.5 93.8 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.898 0.772 . . . . 0.0 111.499 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.85 -24.09 62.46 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -172.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -76.45 -36.62 57.82 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.185 -0.947 . . . . 0.0 112.942 171.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -66.24 -36.07 82.07 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.556 0.743 . . . . 0.0 112.261 170.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -63.65 -50.46 69.2 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.236 1.414 . . . . 0.0 111.088 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.84 -40.18 80.05 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.606 -0.684 . . . . 0.0 113.731 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.49 -37.72 83.27 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 118.765 1.282 . . . . 0.0 111.983 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 t -65.06 -46.03 82.89 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.228 0.611 . . . . 0.0 112.113 171.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.9 mt -57.68 -38.9 75.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.257 1.023 . . . . 0.0 111.996 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 50' ' ' LYS . 1.9 m-85 -56.59 -41.36 76.85 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.797 -0.564 . . . . 0.0 112.39 170.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -19.43 64.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.534 1.134 . . . . 0.0 113.901 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -91.84 -5.59 53.13 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.587 1.085 . . . . 0.0 113.693 168.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 11.35 72.1 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.15 -0.969 . . . . 0.0 114.526 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.5 mt -83.67 51.12 1.94 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.779 1.631 . . . . 0.0 110.616 175.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -55.76 -36.0 66.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.943 1.697 . . . . 0.0 112.85 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -86.94 -33.69 19.6 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.377 -0.827 . . . . 0.0 112.202 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -62.64 -41.02 98.8 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 118.511 0.596 . . . . 0.0 111.431 164.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.39 80.67 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.46 -35.15 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.729 -0.607 . . . . 0.0 111.205 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -62.63 -39.01 92.48 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.403 1.001 . . . . 0.0 112.029 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -64.77 -44.85 88.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.876 0.871 . . . . 0.0 111.781 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -63.06 -38.4 91.03 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.654 -0.654 . . . . 0.0 112.079 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.11 -26.45 68.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.641 1.176 . . . . 0.0 112.368 171.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -72.45 -27.68 62.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.302 1.41 . . . . 0.0 112.969 172.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.42 -44.0 92.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.728 1.149 . . . . 0.0 110.473 170.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.0 mt -66.32 -44.28 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.916 1.286 . . . . 0.0 110.103 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -61.01 -30.14 70.12 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.24 1.016 . . . . 0.0 112.384 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.77 -28.28 30.46 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 173.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -140.71 65.69 25.54 Favored Pre-proline 0 CA--C 1.562 1.409 0 C-N-CA 126.382 1.873 . . . . 0.0 111.552 -168.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -68.35 -19.19 43.96 Favored 'Trans proline' 0 C--N 1.353 0.806 0 N-CA-C 118.179 2.338 . . . . 0.0 118.179 -161.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -102.73 -8.66 20.67 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.381 -0.824 . . . . 0.0 112.736 177.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -77.3 140.76 65.55 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 121.21 -0.931 . . . . 0.0 112.352 -174.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.33 -9.01 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.541 2.161 . . . . 0.0 113.871 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 p -61.74 -46.16 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.948 -1.095 . . . . 0.0 112.233 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.13 -36.1 64.13 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 120.918 -1.114 . . . . 0.0 113.168 175.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -58.3 -39.68 79.96 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.707 1.254 . . . . 0.0 111.492 169.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.5 m -62.02 -29.98 70.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.716 0.806 . . . . 0.0 112.207 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -87.86 -29.45 20.9 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -63.16 -39.78 95.65 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 121.174 1.807 . . . . 0.0 111.205 165.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -34.1 75.86 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.904 -1.123 . . . . 0.0 112.925 169.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 tpt -63.75 -40.18 96.1 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.604 0.762 . . . . 0.0 111.724 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.94 86.96 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.708 0.685 . . . . 0.0 111.869 171.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -56.56 -41.7 77.32 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.42 1.009 . . . . 0.0 112.294 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.7 pt -76.1 -21.05 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.408 ' HB3' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -95.42 -15.7 22.81 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.031 1.287 . . . . 0.0 114.108 178.334 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.95 -28.4 15.82 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.455 1.902 . . . . 0.0 111.294 169.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CZ ' ' A' ' 54' ' ' TYR . . . 104.0 27.12 6.39 Favored Glycine 0 CA--C 1.531 1.078 0 N-CA-C 115.755 1.062 . . . . 0.0 115.755 173.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.02 54.49 1.12 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.385 1.088 . . . . 0.0 109.927 170.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.415 ' CZ ' ' HA2' ' A' ' 52' ' ' GLY . 7.0 m-85 -58.94 -32.79 69.91 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.726 1.21 . . . . 0.0 113.408 -169.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.8 m -75.12 -22.0 58.51 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.458 -0.776 . . . . 0.0 112.099 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.5 mm-40 -74.47 -36.57 63.31 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.58 -1.325 . . . . 0.0 110.931 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.66 -41.96 91.89 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.649 -0.657 . . . . 0.0 112.537 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.7 pt -61.63 -36.96 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.561 0.619 . . . . 0.0 111.998 176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -66.39 -50.33 63.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.297 1.039 . . . . 0.0 110.804 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.9 ttm -63.8 -32.3 73.77 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.1 -42.41 72.74 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 120.867 -1.145 . . . . 0.0 112.093 175.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -71.73 -33.53 68.8 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.112 0.869 . . . . 0.0 111.79 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -36.86 77.84 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.335 1.054 . . . . 0.0 112.418 164.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.26 -29.8 61.71 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 120.266 -1.521 . . . . 0.0 113.902 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.51 -21.8 62.86 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.558 1.679 . . . . 0.0 112.626 172.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -66.11 -9.18 28.81 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 170.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -109.23 27.75 9.21 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.762 2.025 . . . . 0.0 111.985 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 32.1 p -135.18 -0.78 2.69 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 -166.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 69.5 m -79.44 40.51 0.44 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.831 -1.168 . . . . 0.0 113.014 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 t -150.9 145.57 25.72 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.9 -13.53 11.35 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.981 1.312 . . . . 0.0 114.169 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -70.07 -28.04 65.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.769 1.228 . . . . 0.0 112.416 168.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -134.84 21.4 3.54 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.988 1.715 . . . . 0.0 112.697 -169.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.63 -35.22 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 120.642 -1.286 . . . . 0.0 112.168 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.0 68.19 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.21 -0.931 . . . . 0.0 111.784 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.0 mm -67.68 -31.81 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.154 -0.966 . . . . 0.0 111.018 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -57.2 -40.87 78.3 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.248 -0.908 . . . . 0.0 111.441 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.9 m -76.96 -35.45 57.22 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.351 1.46 . . . . 0.0 113.603 174.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -52.36 -63.46 1.13 Allowed 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.779 1.172 . . . . 0.0 110.74 168.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -70.52 -26.63 63.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.073 0.851 . . . . 0.0 112.737 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.81 -35.31 64.87 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.04 1.291 . . . . 0.0 114.012 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.6 65.48 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.965 1.257 . . . . 0.0 111.343 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 57.3 mmt-85 -56.1 -42.93 77.56 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 119.575 1.08 . . . . 0.0 111.406 170.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.7 tp -67.54 -40.68 85.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.801 1.24 . . . . 0.0 112.469 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.63 -37.08 85.97 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.95 0.5 . . . . 0.0 112.31 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.2 -20.78 31.76 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.64 -47.81 83.14 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.281 1.4 . . . . 0.0 110.669 169.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.541 ' HA ' HG12 ' A' ' 91' ' ' VAL . 4.6 pt20 -76.02 -26.96 57.15 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 173.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -25.94 74.22 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 120.82 -1.175 . . . . 0.0 114.78 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -87.46 -33.7 18.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.92 1.288 . . . . 0.0 112.873 174.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.541 HG12 ' HA ' ' A' ' 88' ' ' GLN . 1.7 p . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -173.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 N--CA 1.467 0.408 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -7.66 56.9 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -87.57 -47.85 8.38 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.938 1.295 . . . . 0.0 111.078 170.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -27.73 67.9 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.773 -1.204 . . . . 0.0 112.608 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -28.15 63.7 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.101 1.319 . . . . 0.0 114.042 175.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -76.02 -30.27 58.43 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.687 -1.258 . . . . 0.0 111.369 171.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -71.29 -30.54 66.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 169.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.24 -48.6 81.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.188 0.995 . . . . 0.0 109.743 163.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.2 -38.91 57.39 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.896 0.76 . . . . 0.0 113.738 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -60.51 -47.86 84.32 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.432 1.116 . . . . 0.0 112.317 176.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.8 m -66.3 -36.22 82.4 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.355 0.662 . . . . 0.0 112.599 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -61.14 -44.69 96.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.258 -0.901 . . . . 0.0 111.055 175.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -58.89 -39.73 82.31 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.349 0.977 . . . . 0.0 112.656 169.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -27.93 65.88 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -84.75 -19.74 32.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.454 1.501 . . . . 0.0 113.07 170.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 9.69 38.22 Favored Glycine 0 N--CA 1.477 1.398 0 C-N-CA 125.256 1.408 . . . . 0.0 114.353 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.0 mt -87.41 55.74 3.65 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 127.734 2.414 . . . . 0.0 110.031 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -57.77 -40.2 79.23 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.429 1.092 . . . . 0.0 112.566 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -67.98 -39.34 83.31 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.144 0.884 . . . . 0.0 110.836 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.34 -33.14 71.12 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.255 1.022 . . . . 0.0 113.36 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.26 77.14 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.133 0.879 . . . . 0.0 112.377 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.86 -34.84 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.446 1.099 . . . . 0.0 111.402 174.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 -58.17 -33.85 69.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.286 0.948 . . . . 0.0 112.654 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 70.3 m -69.09 -46.15 68.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.803 0.729 . . . . 0.0 111.524 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -31.59 72.46 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.628 1.104 . . . . 0.0 112.067 174.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.51 -29.51 70.77 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.198 -0.939 . . . . 0.0 112.454 174.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -70.97 -30.45 66.72 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.396 0.998 . . . . 0.0 112.302 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.88 -54.01 47.9 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.849 0.75 . . . . 0.0 110.008 171.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 58.1 mt -73.94 -28.77 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 111.846 -171.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -71.06 -27.21 63.47 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 120.913 -1.117 . . . . 0.0 112.287 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.94 -25.75 27.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 168.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -143.77 78.09 14.49 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.729 1.611 . . . . 0.0 112.213 -166.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -67.1 -22.13 47.89 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.742 2.295 . . . . 0.0 115.575 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -133.98 -11.75 2.59 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -163.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -65.91 128.78 94.06 Favored Pre-proline 0 CA--C 1.547 0.857 0 O-C-N 120.604 -1.31 . . . . 0.0 108.644 164.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.62 -22.45 72.66 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.739 2.292 . . . . 0.0 114.063 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.18 -31.64 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.782 1.633 . . . . 0.0 114.23 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.65 -35.03 62.62 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.153 -0.967 . . . . 0.0 112.214 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -79.01 -37.3 39.5 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.193 0.997 . . . . 0.0 112.279 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.0 p -64.47 -30.41 71.44 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.5 -0.75 . . . . 0.0 112.835 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -79.43 -40.21 30.52 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 172.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -57.52 -40.49 78.88 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.151 0.887 . . . . 0.0 111.818 171.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.32 80.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 172.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -45.85 78.91 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.437 0.695 . . . . 0.0 111.935 172.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.78 -42.74 84.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.368 0.667 . . . . 0.0 111.512 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.99 -43.59 98.63 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.316 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.2 pt -72.47 -27.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 120.771 1.623 . . . . 0.0 113.585 175.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.5 -17.53 56.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.916 0.887 . . . . 0.0 113.164 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.26 -17.43 26.0 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.806 2.042 . . . . 0.0 112.02 166.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.89 29.97 21.91 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.023 1.297 . . . . 0.0 115.044 178.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.65 52.57 0.83 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.977 2.511 . . . . 0.0 109.628 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -58.92 -36.93 75.55 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 120.942 -1.099 . . . . 0.0 112.434 -170.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 m -62.05 -22.67 65.94 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.106 0.962 . . . . 0.0 113.405 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -81.29 -36.34 29.94 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.962 -1.086 . . . . 0.0 111.714 171.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.15 -38.5 78.83 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.8 pt -66.94 -30.84 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.706 0.802 . . . . 0.0 113.012 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -66.0 -49.72 66.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.292 0.637 . . . . 0.0 110.791 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 25.5 ttm -65.99 -31.01 71.67 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.8 m -71.74 -34.98 69.99 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.048 -1.033 . . . . 0.0 112.533 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -70.5 -33.34 71.1 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.086 -1.009 . . . . 0.0 112.346 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.75 -27.35 66.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.494 0.718 . . . . 0.0 112.189 168.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.01 -23.65 48.16 Favored Glycine 0 CA--C 1.538 1.525 0 O-C-N 120.302 -1.499 . . . . 0.0 114.778 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.84 -27.72 44.39 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.603 1.701 . . . . 0.0 112.511 166.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -64.33 -2.66 2.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 115.81 174.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -117.93 28.13 8.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.953 1.701 . . . . 0.0 112.121 -174.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.8 p -123.46 -9.77 7.98 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -161.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.5 p -76.28 32.7 0.12 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -147.42 144.78 28.9 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 127.856 2.462 . . . . 0.0 110.606 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.66 -21.53 64.49 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -61.72 -22.86 65.72 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.49 1.116 . . . . 0.0 113.128 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -129.37 22.03 5.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.678 1.591 . . . . 0.0 113.045 -171.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.28 -27.3 38.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 O-C-N 120.568 -1.332 . . . . 0.0 112.704 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.13 -29.4 34.79 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.842 -1.161 . . . . 0.0 112.014 172.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.0 mm -65.68 -32.63 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.932 1.293 . . . . 0.0 110.945 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -63.15 -37.97 89.31 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.179 -0.95 . . . . 0.0 112.975 177.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.7 m -67.66 -46.01 73.62 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.667 0.787 . . . . 0.0 112.286 166.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.69 -56.12 13.4 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.597 1.159 . . . . 0.0 111.704 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.4 -31.12 68.21 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.598 1.09 . . . . 0.0 113.462 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -71.1 -40.84 71.27 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.748 1.158 . . . . 0.0 112.433 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.28 67.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.38 0.991 . . . . 0.0 111.931 173.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.349 1.431 . . . . 0.0 112.217 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.5 tp -64.94 -37.86 89.06 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.776 0.83 . . . . 0.0 112.229 176.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.47 -46.89 58.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 15.8 tp -73.02 -19.52 61.18 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.619 -1.3 . . . . 0.0 112.596 -177.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.36 87.35 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 120.27 1.395 . . . . 0.0 112.489 168.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . 0.328 0.9 OUTLIER -78.79 -9.75 59.55 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 169.725 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -82.74 -43.76 7.58 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.23 1.395 . . . . 0.0 114.106 166.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.36 -28.99 65.55 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.075 1.75 . . . . 0.0 113.253 -177.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 172.773 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -15.74 57.2 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 175.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -77.01 -48.33 18.23 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.894 -1.128 . . . . 0.0 111.355 166.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -35.6 81.02 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.547 -1.346 . . . . 0.0 112.527 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.41 -21.92 62.79 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -84.55 -38.04 20.48 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.782 1.174 . . . . 0.0 112.253 171.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.86 -32.34 73.82 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 111.736 176.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -56.49 -42.55 78.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.576 1.15 . . . . 0.0 112.107 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.69 -43.09 96.53 Favored Glycine 0 CA--C 1.533 1.216 0 O-C-N 121.587 -0.696 . . . . 0.0 113.252 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -64.5 -37.77 88.68 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.604 -0.939 . . . . 0.0 112.049 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.3 t -66.76 -45.56 78.18 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.654 -0.654 . . . . 0.0 111.877 173.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.33 -36.67 73.75 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 112.575 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.8 -40.73 80.6 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 170.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -38.76 91.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.938 0.895 . . . . 0.0 112.78 175.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 4.24 10.84 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 173.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.16 4.38 90.24 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 121.069 -1.019 . . . . 0.0 114.274 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.7 mt -88.95 55.44 3.35 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.863 1.665 . . . . 0.0 110.674 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -57.05 -39.68 75.33 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.958 0.903 . . . . 0.0 111.837 -175.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.94 -38.21 69.86 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.53 -0.731 . . . . 0.0 111.553 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.53 -40.3 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.252 1.021 . . . . 0.0 111.763 171.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.49 84.11 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.351 -0.843 . . . . 0.0 112.034 175.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -59.37 -35.9 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.743 1.217 . . . . 0.0 111.063 172.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -63.22 -45.55 91.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.438 1.095 . . . . 0.0 111.577 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.15 -43.94 93.65 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.54 1.136 . . . . 0.0 112.011 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 24.7 m-85 -65.86 -35.21 80.03 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 0.0 112.396 174.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -67.94 -25.69 65.59 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.536 -0.728 . . . . 0.0 112.613 173.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.9 mm-40 -66.26 -34.7 78.6 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.283 1.401 . . . . 0.0 111.813 171.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.12 -48.11 83.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 118.689 0.677 . . . . 0.0 110.609 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.8 mt -72.03 -41.41 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.503 1.121 . . . . 0.0 110.212 -177.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.6 m -57.62 -37.93 74.1 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.768 0.827 . . . . 0.0 111.626 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.42 -29.25 47.03 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -136.08 62.16 44.15 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.625 1.57 . . . . 0.0 112.374 -168.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -64.42 -23.85 64.66 Favored 'Trans proline' 0 C--N 1.352 0.725 0 N-CA-C 117.516 2.083 . . . . 0.0 117.516 -161.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -104.01 4.85 34.93 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.267 1.027 . . . . 0.0 113.097 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -84.74 116.25 64.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 120.941 -1.1 . . . . 0.0 110.842 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.457 ' HA ' ' CD2' ' A' ' 41' ' ' TYR . 71.6 Cg_endo -64.19 -13.06 35.7 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.498 2.132 . . . . 0.0 114.223 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -52.24 -42.49 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 124.353 1.061 . . . . 0.0 112.228 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.01 -39.83 62.97 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.683 -0.509 . . . . 0.0 112.272 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 38' ' ' PRO . 2.7 m-30 -59.62 -38.99 82.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 117.576 0.688 . . . . 0.0 110.46 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.4 p -63.89 -35.93 82.27 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -79.43 -29.85 42.05 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.55 -0.718 . . . . 0.0 112.528 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -69.76 -33.17 72.05 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.417 1.008 . . . . 0.0 112.084 168.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.49 91.29 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.714 -1.241 . . . . 0.0 112.36 167.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.6 ttt -60.98 -37.81 83.74 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.641 -0.662 . . . . 0.0 111.865 170.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.417 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.58 -46.59 88.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.885 0.766 . . . . 0.0 111.761 173.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.1 mt -63.18 -37.4 87.07 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.554 -0.716 . . . . 0.0 112.678 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 26.6 pt -76.36 -7.64 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 172.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.37 -18.24 14.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.62 1.568 . . . . 0.0 113.207 176.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 tt -86.25 -34.64 20.35 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.563 1.945 . . . . 0.0 110.484 166.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.28 20.11 9.43 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.809 1.195 . . . . 0.0 114.961 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -96.35 53.61 1.33 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.015 1.726 . . . . 0.0 109.828 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -57.05 -34.58 68.39 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.778 1.231 . . . . 0.0 113.273 -169.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -66.63 -23.79 66.21 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.654 1.182 . . . . 0.0 112.299 176.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -85.63 -34.93 21.25 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.408 -0.807 . . . . 0.0 111.102 168.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.37 97.21 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.378 -0.826 . . . . 0.0 112.479 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.3 pt -59.78 -40.4 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.654 0.661 . . . . 0.0 111.799 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -64.73 -44.93 88.58 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.99 1.316 . . . . 0.0 111.238 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.2 ttm -68.24 -32.67 73.02 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.452 -0.78 . . . . 0.0 112.776 177.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.7 m -69.55 -42.62 74.34 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 120.802 -1.186 . . . . 0.0 111.853 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -60.72 -41.36 95.13 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.441 0.696 . . . . 0.0 111.357 172.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.95 -29.32 69.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 171.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.28 -28.25 45.29 Favored Glycine 0 N--CA 1.474 1.178 0 CA-C-N 120.768 1.622 . . . . 0.0 114.524 174.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.09 -20.76 65.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 119.887 1.844 . . . . 0.0 112.81 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -57.44 -11.98 2.29 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.51 1.524 . . . . 0.0 114.687 165.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -116.09 32.22 6.24 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 126.998 2.119 . . . . 0.0 112.242 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.6 p -136.99 8.48 2.99 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -167.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.2 m -78.62 2.89 17.85 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.4 t -144.27 156.08 44.12 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.891 -1.131 . . . . 0.0 113.177 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.12 -28.0 16.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.171 2.188 . . . . 0.0 116.734 -166.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -75.45 -0.0 18.57 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -132.27 16.91 4.52 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.974 1.71 . . . . 0.0 113.545 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.58 -27.73 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 119.534 -1.979 . . . . 0.0 113.338 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.85 74.2 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.655 -0.653 . . . . 0.0 111.193 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.29 -34.42 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.08 0.952 . . . . 0.0 111.033 174.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -52.51 -59.61 4.23 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.084 0.856 . . . . 0.0 109.901 171.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.7 m -61.64 -39.59 91.86 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.902 1.281 . . . . 0.0 113.115 176.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -79.44 4.4 15.64 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -110.65 -29.29 8.08 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 117.177 -1.392 . . . . 0.0 113.287 152.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -53.86 -57.72 9.91 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 121.315 1.871 . . . . 0.0 111.203 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -31.92 73.01 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.786 -0.571 . . . . 0.0 111.457 -172.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -62.98 -43.57 98.42 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.823 0.849 . . . . 0.0 111.152 174.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -66.92 -42.62 85.07 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.649 1.179 . . . . 0.0 111.194 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.3 -33.98 74.46 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.735 1.214 . . . . 0.0 113.095 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 18.8 mt -93.56 -12.29 29.87 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -46.21 78.41 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.932 1.696 . . . . 0.0 110.298 164.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -74.09 -16.24 61.03 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -76.06 -47.73 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.034 1.778 . . . . 0.0 113.579 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.19 -31.58 66.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.869 1.667 . . . . 0.0 112.816 -176.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.61 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 111.372 0.138 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -15.13 61.88 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.638 -1.289 . . . . 0.0 113.788 176.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.86 -46.67 14.91 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.927 0.891 . . . . 0.0 110.666 165.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -37.3 83.34 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.418 -1.426 . . . . 0.0 112.676 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -73.65 -24.26 59.98 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.918 0.887 . . . . 0.0 113.13 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -83.89 -31.81 25.5 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.15 0.886 . . . . 0.0 113.191 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.46 -45.38 69.19 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.928 0.785 . . . . 0.0 111.183 169.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -50.97 -48.15 61.21 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.841 1.256 . . . . 0.0 110.537 168.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.54 50.32 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 117.805 -1.553 . . . . 0.0 114.792 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -90.23 -41.91 11.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 121.061 2.431 . . . . 0.0 111.575 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.4 t -57.43 -36.83 71.88 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.549 -0.719 . . . . 0.0 112.338 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.2 mt -62.54 -39.64 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.96 -1.088 . . . . 0.0 112.207 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.99 -40.3 96.06 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.876 1.216 . . . . 0.0 112.585 169.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.71 -42.5 83.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.348 0.522 . . . . 0.0 112.223 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -74.7 -36.37 62.72 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.267 1.427 . . . . 0.0 113.278 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.36 10.4 8.0 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.382 1.467 . . . . 0.0 115.577 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -89.89 58.63 4.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.312 2.245 . . . . 0.0 109.64 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -60.07 -37.02 78.66 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.709 1.204 . . . . 0.0 113.595 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.5 mmt-85 -73.65 -42.37 61.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.73 0.695 . . . . 0.0 110.624 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -65.15 -30.04 70.93 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.3 14.09 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.49 0.716 . . . . 0.0 111.308 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.81 -35.31 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.989 1.315 . . . . 0.0 111.907 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -54.62 -45.79 73.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.724 0.809 . . . . 0.0 112.397 170.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.4 m -63.99 -38.92 92.85 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.167 0.894 . . . . 0.0 112.21 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -67.42 -35.83 80.05 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -65.11 -29.05 69.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 118.689 0.677 . . . . 0.0 111.908 174.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -72.3 -26.36 61.94 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.509 1.049 . . . . 0.0 112.764 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.0 mt -62.69 -49.31 75.6 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.204 0.601 . . . . 0.0 110.593 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.3 mt -80.93 -27.6 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.694 1.198 . . . . 0.0 111.195 -173.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.4 m -62.25 -27.89 69.32 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.383 -1.448 . . . . 0.0 112.194 168.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.78 -27.29 16.56 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 171.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -135.83 76.11 54.03 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.067 1.747 . . . . 0.0 110.426 -171.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -61.73 -25.0 78.27 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.938 3.092 . . . . 0.0 118.203 -166.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -116.46 -22.26 8.83 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.673 1.189 . . . . 0.0 112.502 -175.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.02 122.75 65.22 Favored Pre-proline 0 CA--C 1.545 0.777 0 O-C-N 121.657 -0.652 . . . . 0.0 112.57 -168.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.74 -20.4 51.13 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.112 2.541 . . . . 0.0 113.963 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.32 -32.65 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 119.114 0.87 . . . . 0.0 113.291 170.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.14 -40.89 15.05 Favored Glycine 0 C--N 1.34 0.778 0 O-C-N 121.409 -0.807 . . . . 0.0 111.846 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -70.93 -32.67 69.65 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -174.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.0 p -68.41 -41.12 80.88 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.722 1.601 . . . . 0.0 111.753 172.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -70.69 -36.44 73.3 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.832 0.853 . . . . 0.0 111.817 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -74.27 -29.5 61.69 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.565 -1.334 . . . . 0.0 112.115 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.04 -33.08 73.9 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.699 -1.251 . . . . 0.0 112.316 165.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -65.72 -40.58 92.37 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.333 -0.855 . . . . 0.0 111.189 171.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.96 86.79 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.586 -0.696 . . . . 0.0 112.516 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.63 -40.47 87.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.488 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 31.4 pt -76.38 -25.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 120.632 1.56 . . . . 0.0 113.452 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.17 -15.88 59.34 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 119.496 1.044 . . . . 0.0 113.268 172.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -92.28 -34.05 14.39 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.791 1.636 . . . . 0.0 111.734 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.16 25.1 5.18 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.557 2.027 . . . . 0.0 115.982 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -99.0 56.6 1.05 Allowed 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 118.941 1.371 . . . . 0.0 111.938 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -57.44 -30.45 65.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.028 1.331 . . . . 0.0 113.663 -173.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.4 m -72.42 -30.73 64.88 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.178 0.899 . . . . 0.0 112.491 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -78.46 -30.72 47.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.144 0.884 . . . . 0.0 111.281 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.67 -40.84 92.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.98 0.912 . . . . 0.0 112.516 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.9 pt -70.67 -25.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.6 tm0? -72.41 -44.15 62.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.677 0.672 . . . . 0.0 111.165 166.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.4 ttm -58.61 -31.83 68.45 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.78 0.718 . . . . 0.0 112.19 174.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 94.0 m -60.9 -46.89 88.84 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.512 -0.743 . . . . 0.0 112.572 171.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -68.87 -35.98 77.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.254 1.021 . . . . 0.0 112.209 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -27.22 69.01 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.764 0.826 . . . . 0.0 112.454 168.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.4 -27.15 52.85 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.285 -1.51 . . . . 0.0 114.139 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.07 -12.49 55.79 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.096 1.448 . . . . 0.0 112.863 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -71.37 -5.55 33.47 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.22 1.408 . . . . 0.0 114.716 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.54 29.46 5.74 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.467 1.507 . . . . 0.0 113.659 -167.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 70.3 p -117.77 -5.14 11.11 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 -161.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.89 30.57 0.5 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -155.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.8 p -144.32 163.85 32.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.009 1.324 . . . . 0.0 111.828 -176.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.15 -28.12 69.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.099 0.96 . . . . 0.0 113.192 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.16 -19.69 64.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.006 0.922 . . . . 0.0 112.809 172.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -127.66 12.51 6.87 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -171.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 p -64.62 -32.92 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 120.837 -1.164 . . . . 0.0 113.225 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.3 -37.32 52.94 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.273 -0.892 . . . . 0.0 110.645 170.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.17 -37.78 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.905 0.882 . . . . 0.0 112.681 171.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ttp85 -59.16 -40.99 87.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.91 0.884 . . . . 0.0 111.281 176.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.1 m -70.62 -39.44 73.72 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.966 0.906 . . . . 0.0 112.84 167.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -61.96 -29.65 70.39 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.202 1.365 . . . . 0.0 112.715 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.7 -38.28 19.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.717 1.144 . . . . 0.0 113.498 169.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -66.89 -40.75 87.86 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 120.362 1.437 . . . . 0.0 113.706 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -36.81 73.67 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.498 0.59 . . . . 0.0 111.05 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -61.84 -36.14 80.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.881 0.872 . . . . 0.0 111.674 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.9 tt -67.4 -51.21 54.56 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.372 1.469 . . . . 0.0 110.6 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.07 -36.14 74.56 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.506 1.122 . . . . 0.0 112.562 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.48 -7.06 59.4 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 173.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.31 39.19 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 120.876 1.671 . . . . 0.0 109.179 164.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -63.51 -29.0 70.34 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.713 . . . . 0.0 111.388 169.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.41 -43.87 60.59 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 125.784 1.659 . . . . 0.0 113.707 172.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -76.11 -23.07 54.9 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 123.431 0.692 . . . . 0.0 112.839 167.994 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.293 0.0 OUTLIER -71.22 -26.9 63.13 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.525 -1.36 . . . . 0.0 111.782 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -70.77 -13.73 62.16 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.04 -35.61 10.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.488 1.04 . . . . 0.0 112.878 166.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -70.77 -36.73 73.2 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.264 0.938 . . . . 0.0 113.116 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.66 -21.54 66.44 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.909 -1.12 . . . . 0.0 112.804 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -90.52 -34.74 15.43 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.089 1.356 . . . . 0.0 112.481 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -56.08 -41.15 74.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.845 1.258 . . . . 0.0 111.811 174.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.14 -42.3 71.83 Favored Glycine 0 CA--C 1.54 1.608 0 O-C-N 121.442 -0.786 . . . . 0.0 113.546 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -68.57 -40.22 80.66 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.952 1.376 . . . . 0.0 111.289 175.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.6 m -58.74 -36.55 74.49 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.425 -0.797 . . . . 0.0 112.714 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.35 -34.04 76.48 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.88 -1.138 . . . . 0.0 111.809 173.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -70.49 -26.64 63.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -51.12 60.71 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.368 1.44 . . . . 0.0 110.343 166.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -66.55 -33.64 76.12 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -175.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.32 -0.4 8.83 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.956 1.142 . . . . 0.0 115.956 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.2 mt -89.54 53.16 2.52 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.233 2.213 . . . . 0.0 111.342 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -56.08 -36.89 68.63 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.892 1.677 . . . . 0.0 112.971 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -83.27 -28.52 29.08 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.03 -1.044 . . . . 0.0 112.982 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -73.43 -29.0 62.28 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 118.722 0.692 . . . . 0.0 112.118 166.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.21 69.05 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 172.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.6 t -60.24 -37.19 72.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 O-C-N 121.15 -0.969 . . . . 0.0 111.065 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -62.57 -45.75 91.48 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.66 -0.686 . . . . 0.0 112.237 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.5 t -55.19 -47.92 74.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.366 1.067 . . . . 0.0 111.481 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -68.67 -29.95 68.53 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -68.72 -23.47 64.36 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.224 -0.923 . . . . 0.0 112.78 168.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -69.63 -34.84 74.62 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.755 1.161 . . . . 0.0 111.242 172.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.47 -48.55 77.21 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.901 0.773 . . . . 0.0 109.915 174.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.8 mt -63.14 -37.95 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.952 0.501 . . . . 0.0 110.789 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.6 m -58.46 -39.5 80.09 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.47 -0.769 . . . . 0.0 112.027 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.25 -31.0 43.4 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.43 74.49 20.05 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 124.572 1.149 . . . . 0.0 112.859 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -63.35 -28.56 71.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.641 2.894 . . . . 0.0 117.436 -168.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -105.62 4.84 30.67 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.027 1.331 . . . . 0.0 112.957 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.51 120.55 73.18 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.342 -0.849 . . . . 0.0 110.103 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -61.93 -14.59 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 122.318 2.012 . . . . 0.0 114.226 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.4 p -47.14 -50.56 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.155 0.982 . . . . 0.0 111.416 167.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.11 -43.45 93.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 123.924 0.773 . . . . 0.0 112.5 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -63.53 -40.83 98.05 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.356 0.662 . . . . 0.0 112.169 173.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.0 p -67.43 -35.29 78.95 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.34 -0.85 . . . . 0.0 112.761 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -72.25 -38.51 68.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.144 0.978 . . . . 0.0 112.352 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -71.18 -32.26 68.65 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.411 1.005 . . . . 0.0 112.479 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.38 -42.09 96.35 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.114 -0.991 . . . . 0.0 112.322 168.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.0 -42.59 94.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.845 0.858 . . . . 0.0 111.511 171.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.97 90.78 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.706 0.802 . . . . 0.0 112.414 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 48.9 mt -64.51 -34.92 79.35 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.61 -0.681 . . . . 0.0 112.812 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.8 pt -73.62 -35.78 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.73 1.15 . . . . 0.0 112.892 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -12.83 61.36 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.44 1.096 . . . . 0.0 113.159 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.8 tt -93.44 -41.19 9.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.566 1.947 . . . . 0.0 111.528 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 110.63 21.85 6.63 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 124.772 1.177 . . . . 0.0 115.064 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -100.87 51.48 0.86 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.564 1.546 . . . . 0.0 109.67 171.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -51.02 -41.7 59.98 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.6 1.96 . . . . 0.0 112.624 -176.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.1 m -63.72 -25.95 68.43 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 113.158 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -81.19 -35.9 30.8 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.179 -0.951 . . . . 0.0 111.233 171.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -39.41 91.77 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.803 0.841 . . . . 0.0 112.195 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.3 pt -64.32 -34.76 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.762 0.71 . . . . 0.0 112.474 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.5 tm0? -64.47 -47.91 77.22 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.811 0.732 . . . . 0.0 110.551 171.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.5 ttm -63.18 -31.34 72.46 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 178.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.8 m -66.83 -46.18 75.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.971 -1.08 . . . . 0.0 112.362 173.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -72.41 -32.7 66.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.622 0.769 . . . . 0.0 111.867 -178.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -39.0 92.87 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.953 1.301 . . . . 0.0 112.382 164.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.18 -28.19 73.02 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 120.196 -1.565 . . . . 0.0 113.969 177.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.71 -23.1 67.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.454 1.127 . . . . 0.0 112.857 168.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -74.2 -0.18 15.99 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 169.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.22 20.71 15.98 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.597 1.559 . . . . 0.0 113.103 175.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -139.11 126.72 21.84 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.355 -1.466 . . . . 0.0 114.036 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -148.67 -36.02 0.19 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.073 1.749 . . . . 0.0 112.429 167.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.9 p -76.65 167.37 21.96 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.317 1.447 . . . . 0.0 113.622 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.86 -21.03 66.03 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.9 -1.125 . . . . 0.0 113.148 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.37 -28.45 66.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.401 1.08 . . . . 0.0 112.756 170.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -120.87 15.72 11.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.228 1.411 . . . . 0.0 112.369 -169.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.79 -37.24 61.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.247 -0.908 . . . . 0.0 112.259 -178.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.51 -36.41 63.2 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.688 -0.633 . . . . 0.0 110.623 172.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.8 mm -53.08 -39.98 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.397 1.079 . . . . 0.0 112.447 168.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -34.3 76.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.246 1.019 . . . . 0.0 112.257 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.9 m -80.21 -33.33 38.21 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.112 0.965 . . . . 0.0 113.489 166.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -71.94 -3.07 20.51 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.341 1.456 . . . . 0.0 114.382 176.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -96.84 -47.64 5.77 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.182 0.901 . . . . 0.0 112.205 153.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.13 -32.09 69.93 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -171.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.43 -37.99 74.49 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.177 1.353 . . . . 0.0 111.019 173.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.358 4.5 ptp180 -80.41 -12.86 59.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.84 -44.14 67.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.452 1.101 . . . . 0.0 111.168 157.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -35.98 78.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.981 1.312 . . . . 0.0 112.815 171.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.93 -23.83 28.66 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.89 1.276 . . . . 0.0 113.826 176.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.7 75.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.349 1.431 . . . . 0.0 109.715 168.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -59.45 -26.31 65.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.733 1.213 . . . . 0.0 112.01 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.38 -58.7 7.55 Favored Glycine 0 N--CA 1.467 0.732 0 C-N-CA 127.351 2.405 . . . . 0.0 113.622 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.71 -31.73 68.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.1 0.96 . . . . 0.0 112.471 -174.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 176.573 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -24.42 60.98 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.805 -1.185 . . . . 0.0 113.118 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.98 -24.31 30.66 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.998 0.919 . . . . 0.0 111.841 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.2 tttt -70.05 -51.2 33.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.081 1.752 . . . . 0.0 111.674 162.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -25.19 66.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -166.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.72 -40.0 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 172.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -71.19 -30.3 66.23 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.394 0.678 . . . . 0.0 111.655 175.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -68.1 -43.58 78.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.494 1.518 . . . . 0.0 111.05 170.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.36 -53.42 43.28 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.269 0.938 . . . . 0.0 112.679 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -56.37 -48.8 76.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.714 1.257 . . . . 0.0 111.659 174.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.7 t -55.92 -47.45 77.49 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.768 0.827 . . . . 0.0 113.153 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.4 mt -61.28 -28.56 69.27 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.278 -0.889 . . . . 0.0 112.815 -177.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -67.93 -37.49 81.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.282 0.946 . . . . 0.0 113.21 170.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -36.41 81.1 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 119.906 1.23 . . . . 0.0 112.648 172.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -74.5 -6.18 46.94 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 171.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.83 11.5 84.56 Favored Glycine 0 CA--C 1.537 1.462 0 O-C-N 120.37 -1.456 . . . . 0.0 114.992 -178.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 48.5 mt -87.32 54.33 3.11 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.844 2.058 . . . . 0.0 110.613 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -55.88 -36.19 67.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.359 1.063 . . . . 0.0 112.638 -170.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -80.56 -18.47 48.25 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.775 1.23 . . . . 0.0 113.01 -176.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.01 -36.41 17.04 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.063 0.545 . . . . 0.0 111.442 165.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.751 1.22 . . . . 0.0 112.733 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.51 -36.72 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.794 0.838 . . . . 0.0 110.389 172.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -64.85 -43.14 93.99 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.441 1.018 . . . . 0.0 112.872 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.67 -39.39 91.24 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.821 0.737 . . . . 0.0 112.263 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.464 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 32.8 m-85 -75.31 -35.53 61.23 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 175.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -62.38 -36.02 81.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.336 0.971 . . . . 0.0 111.414 171.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -74.71 -15.9 60.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 113.271 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.65 -47.37 84.68 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.304 0.956 . . . . 0.0 110.682 160.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.1 mt -81.79 -25.94 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.337 1.055 . . . . 0.0 112.053 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 m -62.9 -33.15 74.71 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.572 -1.33 . . . . 0.0 111.183 169.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.83 -37.07 18.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.607 1.163 . . . . 0.0 113.404 174.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -129.86 74.14 80.87 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 125.86 1.664 . . . . 0.0 110.603 -169.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -63.13 -19.44 68.8 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.723 2.949 . . . . 0.0 117.537 -167.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -124.3 -10.73 7.5 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.443 1.097 . . . . 0.0 113.107 -171.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -70.13 122.87 87.56 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 124.014 0.926 . . . . 0.0 111.258 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HB2' HG21 ' A' ' 76' ' ' ILE . 85.4 Cg_endo -67.95 -9.23 24.99 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.999 1.8 . . . . 0.0 113.999 179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -46.38 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.605 1.093 . . . . 0.0 110.989 163.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.52 -39.88 95.84 Favored Glycine 0 CA--C 1.527 0.802 0 O-C-N 121.266 -0.896 . . . . 0.0 112.03 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -65.36 -38.86 91.35 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 117.77 0.785 . . . . 0.0 112.128 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 m -62.44 -38.28 89.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.211 1.005 . . . . 0.0 112.041 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -75.14 -40.78 59.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.534 1.133 . . . . 0.0 112.224 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -65.12 -31.79 73.16 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 120.292 -1.505 . . . . 0.0 112.244 173.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.31 -36.53 83.98 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.259 -0.9 . . . . 0.0 112.561 169.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.4 tpp -63.58 -44.11 95.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.099 0.863 . . . . 0.0 111.276 171.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.464 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -57.09 -48.29 78.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.264 0.626 . . . . 0.0 112.08 175.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.59 -39.2 93.3 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.537 -0.727 . . . . 0.0 112.445 -177.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.52 -7.69 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 CA-C-N 120.07 1.305 . . . . 0.0 114.134 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.36 -20.1 14.72 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.053 1.341 . . . . 0.0 113.555 176.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.24 -9.7 49.73 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.411 2.284 . . . . 0.0 111.422 166.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.67 21.48 63.85 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.915 1.245 . . . . 0.0 114.866 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -92.59 51.2 1.7 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.561 1.944 . . . . 0.0 109.402 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -58.15 -37.17 74.14 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.081 -1.012 . . . . 0.0 112.445 -170.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.7 m -52.7 -31.81 39.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.899 1.28 . . . . 0.0 113.484 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -95.84 -27.09 15.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.353 1.461 . . . . 0.0 110.858 -177.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.21 -41.98 80.52 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.933 0.893 . . . . 0.0 112.078 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.5 pt -65.43 -35.01 74.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 118.999 0.818 . . . . 0.0 111.588 177.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -63.26 -45.54 91.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.013 0.925 . . . . 0.0 111.337 170.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 35.2 tpp -60.46 -43.76 96.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.955 0.798 . . . . 0.0 112.299 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.91 -46.61 84.04 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.128 -0.982 . . . . 0.0 112.246 177.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.75 -36.47 83.16 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.857 0.863 . . . . 0.0 112.181 174.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -38.48 84.73 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.176 0.99 . . . . 0.0 111.788 172.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.94 -34.17 65.44 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 120.269 -1.519 . . . . 0.0 113.598 178.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.78 -6.53 27.23 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 118.524 1.162 . . . . 0.0 113.401 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -76.48 -22.56 54.38 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 162.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -92.55 -7.31 47.57 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.862 1.265 . . . . 0.0 114.31 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.0 p -86.54 -1.13 57.37 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 -160.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 m -86.71 42.2 1.0 Allowed 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 120.206 1.366 . . . . 0.0 114.236 -169.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 p -138.62 159.65 41.57 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.198 1.399 . . . . 0.0 111.544 169.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.76 -6.97 17.99 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -87.18 -14.98 39.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.678 1.591 . . . . 0.0 112.259 171.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -126.36 14.51 7.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.455 1.502 . . . . 0.0 114.014 -173.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.19 -14.93 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 120.549 -1.344 . . . . 0.0 114.219 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.95 -39.19 15.95 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.914 -1.116 . . . . 0.0 111.267 164.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.409 HG21 ' HB2' ' A' ' 38' ' ' PRO . 47.6 mm -53.06 -36.48 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.132 0.973 . . . . 0.0 111.371 170.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.3 ttp180 -55.36 -39.5 70.14 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.831 1.252 . . . . 0.0 113.269 175.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.2 m -78.06 -37.9 45.65 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.036 1.335 . . . . 0.0 112.856 170.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.6 mttm -55.37 -51.72 65.88 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.943 1.247 . . . . 0.0 111.381 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.92 -31.19 64.47 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.092 1.315 . . . . 0.0 113.456 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -77.34 -30.72 54.09 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 120.971 1.714 . . . . 0.0 114.568 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -42.2 59.64 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.29 1.405 . . . . 0.0 110.655 166.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -62.16 -32.57 73.21 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.172 0.896 . . . . 0.0 111.688 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.5 tp -67.76 -44.28 77.87 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.756 1.222 . . . . 0.0 112.815 171.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -68.96 -32.46 72.06 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.282 -0.886 . . . . 0.0 113.352 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.6 tp -83.2 -22.12 33.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.46 -0.781 . . . . 0.0 112.678 174.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.92 92.39 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.522 1.51 . . . . 0.0 111.089 164.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -63.58 -30.04 71.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.033 0.933 . . . . 0.0 111.989 172.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.32 -49.57 44.68 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 125.697 1.617 . . . . 0.0 112.538 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.63 -37.55 70.86 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.738 1.215 . . . . 0.0 112.162 -177.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 N--CA 1.479 1.011 0 O-C-N 121.42 -0.8 . . . . 0.0 111.655 174.628 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -35.07 78.6 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.546 1.138 . . . . 0.0 112.332 170.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.257 0.2 OUTLIER -90.35 -14.43 33.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -27.97 32.94 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.667 1.187 . . . . 0.0 112.495 164.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -62.83 -50.68 70.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.958 1.303 . . . . 0.0 113.072 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -59.54 -30.48 68.63 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -49.59 49.5 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.727 -0.608 . . . . 0.0 110.912 171.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -58.72 -37.11 75.44 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.764 0.826 . . . . 0.0 111.56 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.89 -15.01 54.77 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.885 1.231 . . . . 0.0 115.176 174.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -94.84 -45.82 7.14 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.63 1.715 . . . . 0.0 110.754 168.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.3 m -53.41 -44.61 68.86 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.62 0.768 . . . . 0.0 112.755 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 mt -58.91 -38.11 78.18 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.246 1.018 . . . . 0.0 112.825 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -61.5 -38.16 86.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.283 -0.886 . . . . 0.0 112.05 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -71.17 -10.32 59.56 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -102.48 -0.79 31.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.018 1.327 . . . . 0.0 113.868 165.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.22 5.34 82.95 Favored Glycine 0 CA--C 1.536 1.365 0 O-C-N 121.116 -0.99 . . . . 0.0 115.001 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 98.3 mt -83.73 52.74 2.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.746 1.618 . . . . 0.0 110.952 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -56.87 -40.43 76.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.926 1.29 . . . . 0.0 111.924 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -72.96 -39.25 66.34 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.728 -0.653 . . . . 0.0 111.608 -178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -70.26 -32.65 70.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.445 1.02 . . . . 0.0 111.373 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.95 -44.3 89.87 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.015 -1.053 . . . . 0.0 112.183 173.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.97 -42.16 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.656 0.783 . . . . 0.0 110.924 171.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -58.53 -45.55 88.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.05 0.841 . . . . 0.0 112.516 174.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.2 m -62.72 -41.84 99.36 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.538 1.135 . . . . 0.0 112.5 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -67.48 -36.35 80.95 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.462 -0.774 . . . . 0.0 112.244 172.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.37 -28.52 69.75 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.722 0.692 . . . . 0.0 112.576 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -68.99 -28.81 66.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.89 -1.131 . . . . 0.0 112.229 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -63.5 -48.09 79.02 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.772 0.715 . . . . 0.0 110.373 169.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.6 mt -72.11 -24.72 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 C-N-CA 124.845 1.258 . . . . 0.0 111.241 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 94.5 m -68.32 -31.28 70.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.754 1.222 . . . . 0.0 111.455 172.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -85.41 -32.84 22.14 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.985 0.811 . . . . 0.0 112.803 169.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -132.21 77.71 70.29 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.18 1.392 . . . . 0.0 112.672 -169.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -65.98 -18.32 56.91 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 121.87 1.713 . . . . 0.0 115.088 175.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -113.3 -26.72 8.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.042 1.337 . . . . 0.0 112.896 -170.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -70.46 127.44 92.06 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.193 1.361 . . . . 0.0 111.486 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -67.9 -7.63 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.725 2.284 . . . . 0.0 115.277 -176.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 p -55.48 -39.61 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.808 1.243 . . . . 0.0 111.687 171.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.9 -45.56 32.85 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.365 -0.834 . . . . 0.0 112.115 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -64.75 -40.38 95.21 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.744 -0.857 . . . . 0.0 112.388 177.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 72.1 p -69.89 -18.52 63.41 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -83.9 -40.42 18.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 112.078 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.51 -37.69 73.4 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.64 -1.287 . . . . 0.0 112.018 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.98 -29.6 70.94 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 171.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.45 -42.68 87.28 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.042 0.837 . . . . 0.0 111.059 173.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.8 -46.42 87.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.966 0.506 . . . . 0.0 111.602 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 99.3 mt -59.27 -42.31 90.9 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.873 -0.517 . . . . 0.0 112.367 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.6 pt -73.73 -29.46 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.131 0.878 . . . . 0.0 113.339 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.56 -14.16 57.18 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.962 1.256 . . . . 0.0 114.095 175.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.5 tt -87.95 -23.16 23.95 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.39 1.876 . . . . 0.0 111.497 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.75 21.67 33.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.44 1.019 . . . . 0.0 114.463 -177.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -100.58 53.19 0.87 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.039 1.4 . . . . 0.0 110.734 173.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -52.36 -37.92 57.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.774 1.63 . . . . 0.0 112.378 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m -68.59 -15.44 63.53 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.042 1.737 . . . . 0.0 113.376 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -90.53 -33.66 15.84 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.37 -0.831 . . . . 0.0 111.588 165.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.6 -35.15 79.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 113.13 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 pt -62.74 -36.39 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.229 0.922 . . . . 0.0 112.985 177.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -67.06 -41.98 85.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.211 0.605 . . . . 0.0 111.605 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 ttm -76.38 -29.52 57.17 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.79 -39.34 73.2 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.019 -1.051 . . . . 0.0 111.207 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -59.79 -44.03 94.14 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.107 0.867 . . . . 0.0 111.536 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.43 -35.29 71.88 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 175.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.41 -27.18 52.73 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-N 120.265 1.393 . . . . 0.0 114.415 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -59.7 -32.74 70.8 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.266 2.033 . . . . 0.0 112.171 172.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -60.9 -17.61 51.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -85.51 -1.22 56.85 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.595 1.158 . . . . 0.0 112.942 175.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.7 p -106.0 22.06 16.27 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -162.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m -66.18 -32.79 74.44 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 p -104.8 166.65 10.24 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -174.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.87 -23.29 67.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.62 -22.83 64.2 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.828 -1.17 . . . . 0.0 112.656 174.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -124.17 17.46 9.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.21 1.804 . . . . 0.0 112.273 -169.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.09 -27.5 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.567 -1.333 . . . . 0.0 112.919 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.97 63.81 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.284 -0.885 . . . . 0.0 111.038 171.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.8 mm -58.83 -30.72 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.165 0.986 . . . . 0.0 111.261 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -64.94 -38.26 90.39 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.939 -1.1 . . . . 0.0 113.013 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.5 t -68.37 -43.29 77.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.302 1.441 . . . . 0.0 111.529 167.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.3 tppt? -54.21 -53.44 53.53 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.94 0.896 . . . . 0.0 111.814 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -74.23 -31.1 62.46 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 120.098 1.317 . . . . 0.0 114.011 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -75.28 -36.03 61.24 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.743 1.611 . . . . 0.0 113.433 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 -38.58 82.24 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.805 1.639 . . . . 0.0 110.828 172.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -56.06 -37.44 69.28 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 119.494 1.043 . . . . 0.0 111.627 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.8 tp -72.78 -42.83 63.53 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.263 1.025 . . . . 0.0 112.904 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -67.38 -23.66 65.61 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 175.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -97.77 -20.16 17.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.035 1.334 . . . . 0.0 114.211 174.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.27 -49.42 77.92 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.61 1.55 . . . . 0.0 109.498 163.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -64.44 -26.97 68.68 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.427 1.091 . . . . 0.0 112.484 171.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -80.81 -33.94 28.91 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.45 1.024 . . . . 0.0 115.406 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -93.88 -26.01 17.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.014 1.326 . . . . 0.0 112.926 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.479 0.983 0 CA-C-N 119.259 0.936 . . . . 0.0 111.75 170.52 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.59 -17.9 55.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.596 -1.315 . . . . 0.0 113.18 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -74.16 -46.04 44.84 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.965 -1.084 . . . . 0.0 109.632 162.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -43.1 80.65 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.596 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.48 -24.38 61.17 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 120.223 1.374 . . . . 0.0 113.689 -178.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.264 10.9 ptpp? -77.85 -39.03 44.77 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 119.431 1.014 . . . . 0.0 112.71 169.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.14 -40.7 94.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.192 0.997 . . . . 0.0 112.277 170.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -60.85 -49.14 78.69 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.056 1.742 . . . . 0.0 111.34 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -39.36 97.14 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 119.409 1.004 . . . . 0.0 113.134 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -61.03 -42.3 98.22 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.626 1.713 . . . . 0.0 111.948 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.3 m -61.1 -44.4 97.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.218 1.007 . . . . 0.0 111.415 174.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.7 -38.92 92.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.747 1.219 . . . . 0.0 112.093 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -59.66 -35.68 74.9 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.599 1.091 . . . . 0.0 112.435 170.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -19.88 64.96 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 174.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -100.79 3.7 42.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.313 1.045 . . . . 0.0 113.239 170.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.92 13.47 83.36 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 121.122 -0.986 . . . . 0.0 114.768 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.6 mt -87.71 56.32 3.86 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.202 1.801 . . . . 0.0 110.344 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -57.33 -39.56 76.12 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.486 1.114 . . . . 0.0 113.246 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.02 -39.35 75.85 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.95 0.795 . . . . 0.0 110.751 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -64.63 -43.6 93.17 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.407 0.683 . . . . 0.0 111.045 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.31 76.81 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.876 0.871 . . . . 0.0 112.714 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.62 -38.48 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.013 0.925 . . . . 0.0 110.442 173.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -61.11 -42.99 99.55 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.089 0.859 . . . . 0.0 112.865 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.3 m -63.39 -35.13 79.37 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.764 0.826 . . . . 0.0 112.668 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -80.73 -34.15 34.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.28 1.032 . . . . 0.0 112.478 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -62.92 -34.61 77.8 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.211 0.914 . . . . 0.0 110.963 168.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -71.31 -17.65 62.44 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.5 mt -59.41 -46.48 88.58 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.678 1.126 . . . . 0.0 110.605 161.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.4 mt -77.24 -30.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.383 1.073 . . . . 0.0 111.206 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.1 m -62.64 -41.49 99.07 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.662 -1.274 . . . . 0.0 111.113 174.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.92 -30.26 61.2 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 174.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -137.78 62.02 32.45 Favored Pre-proline 0 CA--C 1.556 1.209 0 C-N-CA 124.542 1.137 . . . . 0.0 113.391 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -61.89 -27.97 80.68 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.549 2.166 . . . . 0.0 116.429 -165.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -103.03 -1.43 29.26 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.186 0.995 . . . . 0.0 113.082 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -84.33 123.9 74.43 Favored Pre-proline 0 CA--C 1.543 0.695 0 O-C-N 120.878 -1.139 . . . . 0.0 112.179 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -55.24 -23.81 38.87 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.478 . . . . 0.0 114.928 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.72 -38.95 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.471 1.032 . . . . 0.0 112.844 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.08 -46.31 59.14 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 119.305 0.957 . . . . 0.0 111.521 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -62.91 -40.46 97.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.47 1.108 . . . . 0.0 112.189 173.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.2 m -58.96 -34.5 71.85 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.241 1.016 . . . . 0.0 112.626 174.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.46 -44.19 17.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.794 0.838 . . . . 0.0 111.337 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -60.08 -34.7 73.81 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 121.087 1.767 . . . . 0.0 112.196 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.14 -34.18 77.06 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 168.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.1 tpt -66.11 -44.29 84.75 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.272 1.029 . . . . 0.0 111.727 172.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.62 -45.9 88.23 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.087 0.955 . . . . 0.0 112.065 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.55 -36.02 77.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 118.789 -0.624 . . . . 0.0 112.666 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.1 pt -84.08 -17.24 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 173.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -21.45 46.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.066 1.346 . . . . 0.0 112.049 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -88.2 -63.15 1.34 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.327 1.851 . . . . 0.0 109.542 172.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.66 15.77 0.73 Allowed Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.276 1.271 . . . . 0.0 116.276 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.06 59.71 1.98 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.304 1.552 . . . . 0.0 109.648 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.1 -30.33 68.02 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.602 1.161 . . . . 0.0 113.509 -173.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.7 m -70.11 -20.46 63.19 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.968 0.804 . . . . 0.0 112.176 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -79.09 -34.3 43.69 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.35 -1.469 . . . . 0.0 112.149 166.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.87 -45.5 64.3 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.8 pt -59.56 -40.49 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 CA-C-N 119.411 1.005 . . . . 0.0 111.857 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.0 tm0? -63.35 -49.08 75.31 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.461 1.104 . . . . 0.0 110.924 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.9 ttm -66.11 -28.14 68.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -64.69 -47.26 79.02 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.137 -0.977 . . . . 0.0 111.415 171.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -67.91 -36.09 79.59 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.932 0.493 . . . . 0.0 111.867 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -35.43 74.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.544 0.738 . . . . 0.0 112.565 166.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -73.13 -28.56 66.14 Favored Glycine 0 N--CA 1.471 1.006 0 CA-C-N 120.17 1.35 . . . . 0.0 114.433 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.06 -26.05 68.66 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.371 1.585 . . . . 0.0 112.688 175.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -59.23 -16.96 24.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.103 1.361 . . . . 0.0 114.447 172.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -95.92 13.7 25.97 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.189 1.795 . . . . 0.0 113.967 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.258 16.4 p -122.51 -126.06 0.26 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.51 1.124 . . . . 0.0 113.171 -164.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 74.5 m 56.32 27.33 11.74 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 126.983 2.113 . . . . 0.0 116.475 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.6 t -149.38 154.21 38.57 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.534 -1.354 . . . . 0.0 113.04 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.89 66.94 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 -167.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -77.54 -6.73 54.65 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -124.22 6.97 8.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.512 1.525 . . . . 0.0 113.356 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -64.61 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.357 -1.464 . . . . 0.0 113.553 -173.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.93 -42.23 66.9 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.304 -0.873 . . . . 0.0 111.308 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.24 -41.0 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.05 0.94 . . . . 0.0 111.804 170.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 69.0 ttt-85 -58.18 -47.54 83.11 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.141 0.576 . . . . 0.0 109.868 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.3 m -65.17 -32.3 73.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 117.424 -1.274 . . . . 0.0 113.895 175.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -55.19 -48.33 73.95 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.674 1.579 . . . . 0.0 110.997 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -75.5 -29.02 59.39 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -61.18 -50.48 72.96 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.556 1.525 . . . . 0.0 111.828 170.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -37.04 49.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.015 -0.517 . . . . 0.0 111.8 -174.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -59.48 -35.4 74.03 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.189 0.904 . . . . 0.0 111.588 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.03 -45.96 83.28 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.224 0.92 . . . . 0.0 112.102 172.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.53 -26.78 63.73 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.3 tt -89.61 -28.72 19.34 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.832 0.742 . . . . 0.0 112.622 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.22 -46.05 86.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.534 1.516 . . . . 0.0 111.727 173.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.57 -23.87 67.41 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.686 0.794 . . . . 0.0 112.814 171.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.85 -55.96 10.2 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.833 2.159 . . . . 0.0 114.29 170.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.62 -25.98 64.2 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.138 -1.213 . . . . 0.0 113.221 -176.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.483 1.222 0 O-C-N 121.212 -0.93 . . . . 0.0 113.219 168.677 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 . . . . . 0 CA--C 1.544 0.723 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -38.87 10.08 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.705 1.138 . . . . 0.0 112.802 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -66.02 -16.12 63.63 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -33.15 22.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.901 0.881 . . . . 0.0 113.37 166.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -70.38 -36.56 74.18 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.324 -0.86 . . . . 0.0 112.189 -172.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -57.7 -41.04 80.89 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.438 1.095 . . . . 0.0 112.651 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -69.67 -34.52 74.1 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.043 0.537 . . . . 0.0 111.971 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -65.24 -34.4 78.27 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.259 1.024 . . . . 0.0 111.537 169.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.42 -49.19 58.19 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.294 1.426 . . . . 0.0 113.952 170.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -55.29 -34.63 64.29 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 118.632 1.216 . . . . 0.0 110.951 171.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.9 t -70.63 -40.62 72.99 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.46 1.104 . . . . 0.0 113.487 172.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.3 mt -57.34 -41.09 79.33 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.22 1.373 . . . . 0.0 111.314 174.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.527 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 83.8 m-85 -58.46 -39.98 81.41 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.132 0.878 . . . . 0.0 111.703 170.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -31.3 72.46 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.719 1.208 . . . . 0.0 114.079 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.71 -8.01 59.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.738 1.215 . . . . 0.0 113.761 171.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.495 ' HA2' ' CE1' ' A' ' 20' ' ' TYR . . . 91.16 6.2 66.91 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.995 -1.066 . . . . 0.0 114.437 -173.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 47.2 mt -82.86 44.51 0.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.49 1.516 . . . . 0.0 110.615 -177.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.495 ' CE1' ' HA2' ' A' ' 18' ' ' GLY . 5.0 m-85 -55.76 -34.86 65.6 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 113.032 -168.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -76.84 -35.52 57.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 120.503 1.502 . . . . 0.0 112.116 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.13 -24.48 62.28 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.206 0.603 . . . . 0.0 112.268 168.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -79.92 -35.47 37.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.958 0.903 . . . . 0.0 113.105 174.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.97 -40.36 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 O-C-N 121.015 -1.053 . . . . 0.0 110.402 168.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.01 -35.84 64.81 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.122 0.569 . . . . 0.0 112.026 169.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 t -67.81 -50.86 54.54 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.726 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -34.98 76.01 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.536 1.062 . . . . 0.0 111.58 178.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -62.21 -29.77 70.61 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.611 0.764 . . . . 0.0 112.679 174.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -65.93 -39.78 90.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.245 1.384 . . . . 0.0 111.714 171.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.5 mt -64.54 -37.63 88.22 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.855 -0.528 . . . . 0.0 110.511 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -80.33 -20.72 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 C-N-CA 125.458 1.503 . . . . 0.0 111.533 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.4 m -78.55 -44.44 24.21 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.156 -1.59 . . . . 0.0 111.588 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -91.57 -20.66 21.44 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -133.92 62.26 56.63 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 124.833 1.253 . . . . 0.0 112.169 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -57.45 -27.49 76.33 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.994 3.129 . . . . 0.0 118.699 -164.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -115.48 11.97 16.1 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.416 ' HB3' HG12 ' A' ' 39' ' ' VAL . 3.9 m120 -76.01 134.73 71.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 O-C-N 121.57 -0.706 . . . . 0.0 110.479 170.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.479 ' HB2' HG21 ' A' ' 76' ' ' ILE . 43.8 Cg_endo -55.54 -25.56 50.19 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.638 2.892 . . . . 0.0 113.932 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.416 HG12 ' HB3' ' A' ' 37' ' ' ASN . 6.0 p -55.01 -44.71 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 C-N-CA 125.339 1.456 . . . . 0.0 113.687 -175.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.04 -36.61 91.04 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -69.24 -36.68 77.44 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.122 0.969 . . . . 0.0 111.673 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.7 t -64.42 -42.91 95.78 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.361 -0.837 . . . . 0.0 112.278 172.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -75.43 -24.27 57.04 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -72.78 -37.43 67.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.212 1.005 . . . . 0.0 112.095 168.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.96 89.34 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.069 -1.019 . . . . 0.0 111.829 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.507 ' SD ' ' HE2' ' A' ' 50' ' ' LYS . 33.3 tpp -62.28 -45.53 92.84 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 112.135 171.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.26 -43.4 78.68 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.498 -0.751 . . . . 0.0 112.317 173.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.82 -41.03 92.32 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.699 0.8 . . . . 0.0 112.683 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 43.0 pt -68.85 -35.67 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.407 1.458 . . . . 0.0 112.287 172.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.507 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.2 OUTLIER -74.05 4.73 5.08 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 173.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.9 mt -122.19 3.55 9.82 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 128.26 2.624 . . . . 0.0 113.425 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.1 14.23 77.46 Favored Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.57 47.19 1.06 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.239 1.816 . . . . 0.0 111.86 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -60.05 -34.77 73.87 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.987 -1.071 . . . . 0.0 112.845 -171.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.32 -25.55 68.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.627 1.171 . . . . 0.0 112.532 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -81.29 -41.18 22.53 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.437 0.562 . . . . 0.0 111.054 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.76 88.54 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -175.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.2 pt -64.73 -35.15 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.779 0.718 . . . . 0.0 112.498 174.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -72.22 -44.23 63.24 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.782 0.833 . . . . 0.0 111.046 173.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.4 ttm -62.52 -30.02 70.99 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.885 0.874 . . . . 0.0 112.75 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 91.1 m -65.85 -39.14 90.48 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.99 -1.069 . . . . 0.0 112.113 171.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -70.67 -39.87 73.3 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.858 0.863 . . . . 0.0 112.077 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.07 -35.59 77.36 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.361 0.664 . . . . 0.0 111.529 166.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.22 -31.21 78.48 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 120.539 -1.351 . . . . 0.0 113.279 175.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 98.2 mt -63.56 -29.18 70.47 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.032 1.416 . . . . 0.0 112.808 173.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -66.39 -8.03 23.03 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 170.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -102.68 11.59 37.48 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.036 1.735 . . . . 0.0 112.606 168.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.8 p -126.97 19.28 7.1 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.568 1.547 . . . . 0.0 113.932 -178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 m -81.8 3.83 24.44 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.897 1.279 . . . . 0.0 113.725 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -143.26 150.56 39.44 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 111.328 -166.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.2 -26.1 37.11 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.945 2.202 . . . . 0.0 116.945 -161.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -74.61 -4.81 39.34 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.736 1.153 . . . . 0.0 113.97 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -135.51 11.78 3.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.787 1.235 . . . . 0.0 113.908 -168.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.01 -9.36 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 O-C-N 120.322 -1.486 . . . . 0.0 114.94 -175.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.93 24.52 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.39 0.996 . . . . 0.0 110.459 158.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.479 HG21 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm -62.28 -27.89 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 O-C-N 120.866 -1.146 . . . . 0.0 112.041 174.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -48.35 -38.88 20.32 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.727 1.211 . . . . 0.0 112.438 168.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.7 m -79.36 -35.34 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.225 1.01 . . . . 0.0 113.465 170.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . 0.272 20.9 ttpt -73.69 9.66 1.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 170.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.89 -32.05 7.43 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.723 -1.236 . . . . 0.0 112.855 152.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -81.89 -31.39 31.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.51 -36.15 82.99 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 121.07 1.759 . . . . 0.0 110.191 163.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -63.55 -35.59 80.98 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.521 1.128 . . . . 0.0 111.446 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 21.3 tp -64.18 -45.04 90.11 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.014 1.325 . . . . 0.0 112.576 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -63.57 -32.53 74.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.058 -1.026 . . . . 0.0 113.062 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.9 -29.07 32.54 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.516 1.527 . . . . 0.0 112.499 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.02 -44.82 75.63 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.536 -1.352 . . . . 0.0 111.182 168.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -57.7 -27.34 62.84 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.793 0.837 . . . . 0.0 111.657 165.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.27 -61.8 6.26 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 128.885 3.136 . . . . 0.0 113.234 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.14 -31.28 68.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.866 1.266 . . . . 0.0 113.268 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 N--CA 1.482 1.128 0 CA-C-N 118.462 0.574 . . . . 0.0 111.742 170.363 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.37 -39.31 59.33 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.308 9.7 pt-20 -75.75 -10.0 59.06 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.33 0.968 . . . . 0.0 112.941 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -75.13 -57.53 3.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.254 1.422 . . . . 0.0 111.656 156.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -65.07 -34.93 79.59 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -167.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -65.18 -19.87 66.18 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -105.69 -21.36 13.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.616 1.566 . . . . 0.0 113.178 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -55.45 -34.73 64.75 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.158 1.345 . . . . 0.0 111.334 163.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -57.79 -28.96 61.02 Favored Glycine 0 CA--C 1.539 1.59 0 CA-C-O 119.016 -0.88 . . . . 0.0 114.724 172.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -60.76 -49.79 76.09 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.752 1.776 . . . . 0.0 111.87 174.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.5 t -68.92 -30.0 68.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.718 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 76.6 mt -64.31 -41.49 96.8 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.573 -1.329 . . . . 0.0 112.172 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -61.1 -34.94 75.75 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.376 -0.827 . . . . 0.0 112.643 168.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.2 -22.85 51.74 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -78.33 -26.31 46.8 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.436 1.094 . . . . 0.0 111.867 164.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.2 14.16 39.89 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.407 1.003 . . . . 0.0 113.951 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.43 58.62 4.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 127.228 2.211 . . . . 0.0 109.367 178.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -57.47 -36.45 71.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.782 0.833 . . . . 0.0 112.911 -172.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -79.86 -28.5 40.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.532 1.06 . . . . 0.0 111.553 -176.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -69.49 -38.11 77.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.664 0.785 . . . . 0.0 112.412 163.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -32.93 74.3 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 176.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.6 t -69.01 -38.97 79.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.138 0.975 . . . . 0.0 111.033 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -60.73 -33.77 73.41 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.141 -0.974 . . . . 0.0 113.002 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 p -74.01 -34.86 64.31 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 117.763 -1.113 . . . . 0.0 113.942 173.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.251 0.2 OUTLIER -67.09 -33.92 76.51 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.136 1.789 . . . . 0.0 111.693 169.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -62.53 -28.34 69.78 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.413 -0.804 . . . . 0.0 111.892 175.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -68.36 -33.8 74.93 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.709 -1.244 . . . . 0.0 112.539 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.63 -44.27 62.16 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.881 0.764 . . . . 0.0 109.19 177.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -70.85 -20.63 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.073 0.949 . . . . 0.0 112.103 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.5 m -68.63 -39.83 80.6 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.416 -1.428 . . . . 0.0 111.431 168.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -90.3 -28.22 18.91 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -177.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -132.29 60.26 49.64 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 126.151 1.78 . . . . 0.0 111.96 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -59.86 -26.56 82.66 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.195 2.596 . . . . 0.0 115.983 -170.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -106.97 4.44 27.17 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.492 1.517 . . . . 0.0 112.339 -170.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -93.13 130.32 36.4 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 120.813 -1.179 . . . . 0.0 112.969 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.41 -24.05 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.754 2.303 . . . . 0.0 114.107 174.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.49 -30.33 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 173.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.62 -42.35 55.01 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.357 -0.839 . . . . 0.0 111.121 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.45 -29.87 61.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 26.5 p -66.15 -42.9 88.42 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.105 1.321 . . . . 0.0 111.206 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -67.9 -44.51 76.81 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.475 0.71 . . . . 0.0 111.479 176.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -59.22 -41.91 89.76 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.851 0.86 . . . . 0.0 112.399 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.81 -37.29 86.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.379 0.991 . . . . 0.0 112.505 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.6 tpt -70.02 -39.58 75.71 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.626 0.648 . . . . 0.0 111.927 175.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.73 99.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.756 0.822 . . . . 0.0 111.735 172.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.84 -45.04 93.65 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.581 -0.699 . . . . 0.0 111.506 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 29.3 pt -68.44 -30.45 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.028 1.286 . . . . 0.0 112.87 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -11.37 59.85 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 175.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.6 tt -88.97 -29.08 19.79 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.07 1.748 . . . . 0.0 111.084 164.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 107.27 15.42 15.89 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.687 1.613 . . . . 0.0 114.695 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.93 48.71 1.06 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.312 2.245 . . . . 0.0 110.751 -178.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -59.85 -32.6 70.85 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.67 -1.269 . . . . 0.0 112.974 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 55.4 m -55.82 -31.35 62.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.162 1.785 . . . . 0.0 112.787 171.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -79.5 -39.08 32.9 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.669 0.788 . . . . 0.0 111.206 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.43 -39.61 89.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.869 0.868 . . . . 0.0 112.758 -176.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -65.2 -30.54 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.262 0.937 . . . . 0.0 112.912 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -77.35 -36.23 53.96 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.988 0.915 . . . . 0.0 111.698 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.9 ttm -66.65 -30.97 71.36 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 0.0 112.561 173.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 86.8 m -61.92 -43.16 99.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.321 -0.862 . . . . 0.0 111.927 171.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -65.94 -40.0 90.97 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.756 1.223 . . . . 0.0 112.916 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.26 -27.68 69.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.153 0.581 . . . . 0.0 112.312 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -22.17 61.25 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 120.606 -1.309 . . . . 0.0 114.717 174.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.618 ' CD2' HE22 ' A' ' 81' ' ' GLN . 42.4 mt -59.21 -27.35 65.65 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.847 1.824 . . . . 0.0 112.263 171.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -59.88 -10.76 4.33 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.397 1.879 . . . . 0.0 115.458 174.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -124.28 42.0 3.36 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.331 1.853 . . . . 0.0 112.712 -168.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.2 p -129.88 -12.68 4.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -164.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 60.4 m -81.64 49.46 1.33 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -168.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.2 t -164.07 153.35 13.96 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.904 1.681 . . . . 0.0 110.518 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.77 -11.08 32.73 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 120.993 -1.067 . . . . 0.0 113.139 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.49 -31.82 73.09 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.618 1.167 . . . . 0.0 111.932 165.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -130.87 16.87 5.19 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.238 1.415 . . . . 0.0 113.82 -169.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.6 p -69.98 -28.1 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 120.505 -1.372 . . . . 0.0 113.069 178.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.65 -34.99 22.93 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.36 0.664 . . . . 0.0 111.294 170.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 12.8 mm -51.38 -41.72 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 121.468 -0.77 . . . . 0.0 111.052 166.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -55.26 -47.33 75.62 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.847 0.749 . . . . 0.0 111.533 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.6 m -61.86 -42.29 98.87 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.975 1.31 . . . . 0.0 111.875 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -70.32 -4.02 20.13 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.577 1.551 . . . . 0.0 114.153 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -102.76 -31.62 10.23 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.8 1.182 . . . . 0.0 112.983 157.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.618 HE22 ' CD2' ' A' ' 65' ' ' LEU . 10.7 mm-40 -61.12 -53.59 55.14 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.837 1.653 . . . . 0.0 112.079 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -33.65 68.59 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.288 0.495 . . . . 0.0 111.105 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 tpp85 -66.3 -33.2 75.21 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.678 1.191 . . . . 0.0 111.684 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tt -66.82 -50.78 61.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.39 0.676 . . . . 0.0 110.445 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.03 -37.16 71.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 177.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.32 -26.35 35.7 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.925 1.29 . . . . 0.0 112.689 178.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.71 -42.62 90.89 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.743 1.61 . . . . 0.0 110.484 169.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.51 -29.54 70.57 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.453 0.701 . . . . 0.0 111.274 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.93 -60.33 8.61 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 127.756 2.598 . . . . 0.0 113.694 172.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.61 -27.24 68.51 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.419 1.887 . . . . 0.0 113.027 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 175.762 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 . . . . . 0 CA--C 1.545 0.767 0 N-CA-C 111.309 0.115 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -15.42 60.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 174.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -75.49 -50.89 14.33 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.756 -1.215 . . . . 0.0 111.429 164.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.276 0.0 OUTLIER -67.22 -29.4 69.04 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.853 1.206 . . . . 0.0 113.658 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.34 -39.14 71.51 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.023 1.283 . . . . 0.0 112.764 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -65.99 -20.44 66.19 Favored 'General case' 0 N--CA 1.485 1.289 0 O-C-N 120.886 -1.134 . . . . 0.0 113.111 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -95.54 -32.44 12.84 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.096 0.958 . . . . 0.0 112.568 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -59.07 -42.94 91.55 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.253 1.021 . . . . 0.0 111.045 170.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.6 -39.65 61.12 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-N 118.82 0.736 . . . . 0.0 113.753 173.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -70.1 -39.9 75.24 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.607 1.204 . . . . 0.0 111.178 177.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.3 t -60.29 -43.08 96.58 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 122.782 0.433 . . . . 0.0 111.426 172.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.8 mt -59.38 -40.66 87.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.222 -0.924 . . . . 0.0 111.652 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.141 1.337 . . . . 0.0 113.022 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.471 ' HE2' ' N ' ' A' ' 16' ' ' LYS . 1.1 mpmm? -68.11 -18.21 64.58 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 175.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -91.89 -7.14 50.08 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.912 1.285 . . . . 0.0 113.124 166.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.21 9.22 86.84 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 121.136 -0.977 . . . . 0.0 114.965 -175.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.0 mt -80.23 46.86 0.86 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.888 2.075 . . . . 0.0 111.893 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -50.7 -41.68 56.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.012 1.725 . . . . 0.0 113.431 -173.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -73.28 -27.4 61.54 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.288 0.949 . . . . 0.0 111.76 -175.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -81.88 -36.07 28.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.507 0.723 . . . . 0.0 111.065 170.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.24 71.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.624 1.17 . . . . 0.0 113.079 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.7 t -56.98 -40.86 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.771 1.228 . . . . 0.0 110.922 177.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.61 -42.07 98.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.538 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -61.26 -46.21 91.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 0.0 112.149 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -65.46 -33.23 75.45 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -69.62 -28.04 65.58 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.708 0.686 . . . . 0.0 112.362 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -66.42 -31.65 72.54 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.525 1.057 . . . . 0.0 112.096 173.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.3 mt -58.3 -37.7 75.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.423 1.011 . . . . 0.0 111.209 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -79.51 -22.92 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 122.711 0.405 . . . . 0.0 111.888 177.132 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -69.77 -41.46 75.14 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.798 -1.189 . . . . 0.0 111.083 169.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.21 -34.54 23.9 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -176.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -124.67 66.56 47.52 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 125.345 1.458 . . . . 0.0 112.697 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -58.39 -22.4 58.31 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.632 2.888 . . . . 0.0 119.01 -166.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -122.23 16.3 10.65 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.54 1.064 . . . . 0.0 112.653 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.7 m120 -89.5 124.29 64.65 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 111.215 174.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.24 -16.35 53.9 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.417 2.078 . . . . 0.0 113.949 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.48 HG12 ' HB3' ' A' ' 37' ' ' ASN . 4.4 p -51.58 -46.77 37.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.56 1.073 . . . . 0.0 111.892 171.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.26 -43.42 92.95 Favored Glycine 0 C--N 1.34 0.766 0 C-N-CA 123.522 0.582 . . . . 0.0 111.934 -176.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -58.89 -37.81 77.44 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 117.611 0.705 . . . . 0.0 112.431 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.4 p -65.35 -38.05 88.93 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.774 -1.204 . . . . 0.0 112.886 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -76.02 -37.11 58.79 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.83 0.852 . . . . 0.0 111.995 178.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.18 -33.46 70.01 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.9 -1.125 . . . . 0.0 112.505 175.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.43 83.49 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 120.922 -1.112 . . . . 0.0 111.717 166.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.4 tpt -63.35 -43.45 97.67 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.128 0.571 . . . . 0.0 111.812 173.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.16 -44.78 83.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.084 0.954 . . . . 0.0 112.1 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -64.18 -34.25 77.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.75 0.82 . . . . 0.0 112.848 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.3 pt -80.54 -17.14 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.735 1.152 . . . . 0.0 114.07 171.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.41 -13.13 53.03 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.466 1.506 . . . . 0.0 113.222 171.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 tt -101.82 -38.68 7.74 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.914 2.086 . . . . 0.0 112.077 173.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.19 22.44 5.88 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 124.726 1.155 . . . . 0.0 115.678 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -103.75 53.89 0.75 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.598 1.19 . . . . 0.0 109.094 169.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.51 -34.0 66.57 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 112.83 -173.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.9 m -64.82 -26.34 68.3 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.89 0.768 . . . . 0.0 112.144 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -75.62 -33.4 60.51 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.034 -1.041 . . . . 0.0 112.015 169.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.0 -40.59 71.76 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 112.75 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 25.4 pt -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.938 0.79 . . . . 0.0 112.068 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -62.38 -46.83 86.85 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.882 0.873 . . . . 0.0 110.985 170.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 50.3 ttm -62.2 -32.28 72.91 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.59 -0.693 . . . . 0.0 112.834 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.73 -49.53 62.13 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.051 -1.031 . . . . 0.0 112.031 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.43 -33.96 77.17 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 122.971 0.509 . . . . 0.0 111.811 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -26.37 68.03 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.462 1.505 . . . . 0.0 113.349 169.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.44 -31.55 37.06 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 120.335 -1.478 . . . . 0.0 114.11 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.0 -32.01 70.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.611 1.705 . . . . 0.0 112.161 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -52.77 -22.63 5.53 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.48 1.512 . . . . 0.0 114.581 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -81.42 -12.83 58.81 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.439 1.495 . . . . 0.0 114.145 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -103.03 10.57 38.04 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 118.188 2.662 . . . . 0.0 118.188 -148.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -76.71 37.24 0.17 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.5 t -151.59 148.55 28.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.591 1.556 . . . . 0.0 111.278 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.31 -15.47 16.24 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 172.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -67.77 -26.83 66.31 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.174 0.897 . . . . 0.0 112.111 169.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -128.03 17.09 6.72 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.683 1.593 . . . . 0.0 113.665 -174.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.2 p -63.42 -31.17 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 120.093 -1.63 . . . . 0.0 112.595 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.02 -10.5 59.77 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.02 1.328 . . . . 0.0 113.756 174.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.3 mm -84.3 -35.85 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.829 1.251 . . . . 0.0 110.339 168.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -57.2 -39.35 75.24 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.694 1.198 . . . . 0.0 111.731 176.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.2 p -71.14 -47.5 57.49 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.082 0.953 . . . . 0.0 112.544 171.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 mttm -48.56 -57.26 6.45 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.403 1.002 . . . . 0.0 111.838 176.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.15 -30.07 67.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 117.979 -1.01 . . . . 0.0 112.976 -173.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -76.55 -38.06 55.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.651 1.569 . . . . 0.0 113.602 175.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.23 -39.2 65.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.703 1.138 . . . . 0.0 111.321 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.369 15.6 ptp180 -77.04 -11.24 59.78 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.448 1.476 . . . . 0.0 114.412 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.5 -41.44 55.32 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.248 1.019 . . . . 0.0 112.171 161.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.62 -39.19 83.45 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.104 -0.998 . . . . 0.0 111.343 167.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.47 -28.05 41.54 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.394 1.078 . . . . 0.0 113.572 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.72 89.07 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.751 1.16 . . . . 0.0 110.986 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.0 -26.96 68.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.839 0.856 . . . . 0.0 111.423 170.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.28 -49.65 55.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.728 2.109 . . . . 0.0 114.421 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.99 -27.14 61.62 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.611 -0.935 . . . . 0.0 112.562 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 N--CA 1.483 1.216 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -178.726 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 mp0 . . . . . 0 CA--C 1.546 0.805 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -34.52 26.13 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.614 1.097 . . . . 0.0 112.981 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -64.06 -23.51 67.35 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.502 1.521 . . . . 0.0 112.535 167.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.85 -46.34 25.07 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 125.962 1.705 . . . . 0.0 111.314 171.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -70.51 -27.25 64.04 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -62.53 -29.19 70.39 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 119.303 0.956 . . . . 0.0 112.967 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -85.83 -30.21 23.15 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 172.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.13 -43.88 91.99 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.983 -1.073 . . . . 0.0 111.091 171.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.22 91.44 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-O 119.231 -0.76 . . . . 0.0 114.079 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -55.21 -54.05 48.32 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.551 1.175 . . . . 0.0 110.358 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.6 t -57.86 -43.69 86.13 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.406 1.082 . . . . 0.0 112.166 177.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.33 -33.07 73.0 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.211 -0.931 . . . . 0.0 112.937 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -66.16 -40.04 90.24 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.844 1.202 . . . . 0.0 113.131 171.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -61.53 -40.43 94.63 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.708 -0.62 . . . . 0.0 112.151 173.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -18.85 64.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.417 1.265 . . . . 0.0 114.417 171.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.99 11.93 69.21 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 123.94 0.781 . . . . 0.0 114.864 -176.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.4 mt -89.03 57.52 4.15 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.234 1.814 . . . . 0.0 109.903 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -56.8 -39.24 73.77 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.939 1.295 . . . . 0.0 114.056 -170.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -83.33 -27.99 29.36 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.124 0.874 . . . . 0.0 111.582 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -70.74 -33.2 70.57 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.175 0.443 . . . . 0.0 111.925 164.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.31 -49.11 68.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.661 0.664 . . . . 0.0 111.803 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.3 t -59.05 -37.03 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.981 -1.009 . . . . 0.0 111.02 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -54.99 -42.14 72.09 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.859 1.209 . . . . 0.0 112.912 174.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.3 m -66.46 -37.06 84.3 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.091 0.859 . . . . 0.0 112.685 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 81.4 m-85 -75.06 -38.27 61.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 175.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -64.23 -35.72 81.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.26 0.624 . . . . 0.0 110.636 173.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -23.31 66.4 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 173.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.3 mt -60.61 -42.17 96.29 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.146 1.339 . . . . 0.0 109.46 168.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.1 mt -82.95 -28.6 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.4 1.48 . . . . 0.0 112.147 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -58.5 -32.87 69.2 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.662 -1.274 . . . . 0.0 111.512 168.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -89.61 -29.09 19.09 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 175.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -136.16 68.85 63.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 124.987 1.315 . . . . 0.0 110.774 -168.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -61.29 -36.8 77.53 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.291 1.994 . . . . 0.0 115.552 -163.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.37 6.8 38.94 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -174.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -105.24 130.49 23.01 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -158.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.49 -17.31 53.09 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.555 2.17 . . . . 0.0 113.414 168.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.78 2.44 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.613 1.565 . . . . 0.0 114.7 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -116.6 -36.97 1.02 Allowed Glycine 0 CA--C 1.531 1.09 0 O-C-N 121.5 -0.75 . . . . 0.0 112.679 155.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -60.29 -44.05 95.72 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.036 1.418 . . . . 0.0 112.881 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.4 p -67.8 -27.36 66.67 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.658 -0.651 . . . . 0.0 112.294 -177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -84.04 -42.24 16.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.495 . . . . 0.0 110.908 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -64.66 -32.12 73.64 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.245 -0.909 . . . . 0.0 112.335 172.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.49 -37.04 85.76 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.125 -0.984 . . . . 0.0 112.633 170.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 tpt -66.14 -38.74 88.87 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.856 0.862 . . . . 0.0 111.735 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.405 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.8 -42.35 93.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.409 0.684 . . . . 0.0 111.831 174.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.2 -36.68 84.93 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 118.58 -0.724 . . . . 0.0 112.68 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.3 pt -68.49 -33.84 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.312 1.415 . . . . 0.0 112.37 169.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.79 -12.33 60.02 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 -17.14 38.28 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.917 2.087 . . . . 0.0 111.039 163.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.8 22.09 56.34 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.856 1.217 . . . . 0.0 114.308 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -107.73 57.94 0.62 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.891 1.676 . . . . 0.0 110.123 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -56.21 -36.22 68.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.579 1.552 . . . . 0.0 112.497 -175.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.6 m -62.27 -26.73 68.56 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.387 0.994 . . . . 0.0 112.625 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -84.09 -28.74 27.33 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.511 -0.743 . . . . 0.0 111.93 172.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.16 -36.43 58.75 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.177 0.991 . . . . 0.0 113.298 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -68.17 -32.08 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.023 0.829 . . . . 0.0 111.996 175.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -61.55 -50.48 72.47 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.22 0.608 . . . . 0.0 110.049 166.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.5 ttm -69.09 -32.41 71.82 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -174.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -70.35 -39.59 74.58 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.827 -1.171 . . . . 0.0 112.034 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -73.07 -28.68 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.736 1.153 . . . . 0.0 113.394 171.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -32.12 73.51 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.878 -1.139 . . . . 0.0 111.265 166.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.11 -22.7 73.28 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-O 117.87 -1.516 . . . . 0.0 114.514 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.6 mt -56.84 -29.71 63.08 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.288 2.044 . . . . 0.0 112.313 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -64.7 -1.13 1.71 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.193 1.797 . . . . 0.0 114.516 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -130.41 37.65 3.83 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.553 1.941 . . . . 0.0 111.482 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -129.73 -14.19 4.1 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 -167.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.6 m -80.12 22.4 0.52 Allowed 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -163.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 p -141.33 161.27 38.3 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 119.659 1.118 . . . . 0.0 111.97 -173.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.57 67.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -66.91 -18.22 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.237 1.015 . . . . 0.0 113.068 170.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -126.63 14.89 7.59 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.261 1.424 . . . . 0.0 113.88 -173.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.29 -29.99 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.975 -1.078 . . . . 0.0 113.055 177.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.76 -44.94 54.65 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.067 -1.021 . . . . 0.0 110.886 170.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.87 -35.84 53.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.275 1.43 . . . . 0.0 112.459 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 21.6 ttp-105 -58.83 -39.72 82.06 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.23 1.012 . . . . 0.0 112.219 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -77.7 -39.2 45.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.569 1.148 . . . . 0.0 112.234 172.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -68.59 -16.93 64.02 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -178.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -91.07 -32.09 16.01 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.053 1.297 . . . . 0.0 113.705 163.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -78.55 -42.3 29.68 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.402 1.455 . . . . 0.0 113.319 -175.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -34.86 78.74 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.969 1.259 . . . . 0.0 110.814 171.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -67.39 -36.93 82.28 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.681 1.593 . . . . 0.0 111.989 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.0 tp -67.96 -39.38 83.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.716 1.206 . . . . 0.0 112.051 170.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.5 -39.89 94.95 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.265 -0.897 . . . . 0.0 112.383 169.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.9 -29.51 62.1 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.981 1.264 . . . . 0.0 112.863 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.47 96.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.96 -1.088 . . . . 0.0 111.169 167.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.496 ' HA ' HG12 ' A' ' 91' ' ' VAL . 38.2 mt-30 -69.99 -19.89 63.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.216 1.006 . . . . 0.0 112.566 172.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -65.86 -62.8 4.46 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.819 2.152 . . . . 0.0 112.757 168.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.97 63.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -175.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 88' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.476 0.826 0 O-C-N 121.101 -0.999 . . . . 0.0 112.933 171.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 120.83 0.347 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.37 60.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.045 0.938 . . . . 0.0 113.298 176.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.22 -45.13 57.98 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 120.772 -1.205 . . . . 0.0 111.656 165.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -25.63 60.35 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.446 1.475 . . . . 0.0 113.855 178.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -75.58 -26.57 58.03 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.363 0.983 . . . . 0.0 113.274 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -69.33 -39.23 78.32 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.003 -1.061 . . . . 0.0 111.725 170.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.0 -39.06 93.27 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 169.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -59.44 -43.03 93.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.853 0.861 . . . . 0.0 111.479 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.23 -56.15 25.77 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 118.783 0.72 . . . . 0.0 112.183 173.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -54.89 -42.97 72.77 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.942 0.897 . . . . 0.0 111.852 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.8 t -68.88 -38.88 79.96 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.951 1.701 . . . . 0.0 113.43 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.4 mt -65.88 -35.36 80.43 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.779 -1.201 . . . . 0.0 111.322 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -63.3 -40.67 97.99 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.362 0.983 . . . . 0.0 112.269 169.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.06 -33.53 76.0 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.344 -0.847 . . . . 0.0 112.618 177.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.02 -30.82 55.96 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.456 1.102 . . . . 0.0 113.399 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.78 12.36 20.96 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.433 1.492 . . . . 0.0 115.12 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.77 53.79 2.94 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.058 1.743 . . . . 0.0 109.642 174.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -57.61 -36.32 71.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.57 1.148 . . . . 0.0 113.606 -168.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mmt-85 -75.84 -38.37 58.09 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.943 -1.098 . . . . 0.0 111.726 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.78 -31.91 71.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.694 0.397 . . . . 0.0 111.632 172.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.16 98.56 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.04 0.936 . . . . 0.0 112.65 171.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.72 -41.27 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.735 0.814 . . . . 0.0 111.299 173.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.1 m-70 -59.65 -38.46 81.48 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.226 0.921 . . . . 0.0 112.568 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 m -66.28 -26.46 67.34 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 117.72 -1.133 . . . . 0.0 113.573 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.93 -37.49 39.64 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 121.022 1.737 . . . . 0.0 112.261 168.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.87 -29.95 71.14 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.097 0.862 . . . . 0.0 112.094 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -66.64 -36.52 82.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.896 172.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.0 mt -63.8 -41.79 97.84 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.838 1.199 . . . . 0.0 111.217 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.21 -23.09 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.896 0.879 . . . . 0.0 111.019 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.4 m -78.17 -40.81 36.64 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.275 -0.89 . . . . 0.0 111.582 171.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.66 -31.5 24.14 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -129.69 66.39 77.14 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 126.169 1.787 . . . . 0.0 112.02 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -60.01 -26.69 83.11 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 123.297 2.664 . . . . 0.0 116.91 -170.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -106.56 5.86 29.51 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.456 1.503 . . . . 0.0 112.128 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.4 137.63 32.4 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 121.017 -1.052 . . . . 0.0 111.893 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HB2' HG21 ' A' ' 76' ' ' ILE . 57.9 Cg_endo -63.39 -22.78 71.67 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.176 1.917 . . . . 0.0 114.039 176.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.1 p -57.82 -42.09 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.971 1.308 . . . . 0.0 113.702 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.65 -40.39 46.37 Favored Glycine 0 N--CA 1.468 0.829 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -64.3 -37.34 87.14 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.239 1.02 . . . . 0.0 111.769 173.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.4 m -59.39 -30.22 68.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.961 0.904 . . . . 0.0 112.676 172.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.274 6.0 m120 -103.36 -16.07 15.74 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -176.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -65.96 -43.09 88.95 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.187 0.903 . . . . 0.0 110.648 155.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.35 89.26 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.143 -0.973 . . . . 0.0 112.661 170.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.2 tpt -62.61 -44.21 96.88 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.606 0.762 . . . . 0.0 112.324 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -46.03 89.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.178 0.991 . . . . 0.0 111.94 175.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.5 mt -59.45 -38.83 81.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.48 0.712 . . . . 0.0 112.349 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.4 pt -77.51 -27.98 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.758 1.163 . . . . 0.0 112.929 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -12.6 61.02 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 171.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 mt -118.16 -5.94 10.9 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.866 2.066 . . . . 0.0 114.957 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.32 45.37 8.13 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 119.264 0.938 . . . . 0.0 115.319 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -118.04 49.57 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.821 1.649 . . . . 0.0 110.094 169.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.27 -35.05 71.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.474 1.11 . . . . 0.0 112.959 -168.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.6 m -65.01 -31.26 72.4 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.625 1.17 . . . . 0.0 112.52 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -81.36 -31.31 33.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.087 0.555 . . . . 0.0 110.957 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.44 -44.95 85.71 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.712 -0.618 . . . . 0.0 111.621 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.9 pt -63.95 -29.69 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.997 0.817 . . . . 0.0 113.072 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -63.82 -49.62 72.13 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.49 0.716 . . . . 0.0 110.81 168.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 30.1 ttm -69.61 -26.2 64.32 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 71.0 m -60.25 -45.65 92.52 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.437 -0.789 . . . . 0.0 111.307 170.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -71.13 -40.57 71.31 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.461 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.91 -34.1 71.31 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.3 -0.875 . . . . 0.0 111.756 171.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.81 -20.22 74.04 Favored Glycine 0 CA--C 1.533 1.204 0 O-C-N 120.66 -1.275 . . . . 0.0 115.025 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.18 -35.19 73.13 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.971 1.886 . . . . 0.0 111.17 166.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -72.55 -2.56 20.27 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -105.89 -5.12 19.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.953 1.301 . . . . 0.0 112.699 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 74.4 p -137.75 0.97 2.27 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -162.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.4 m -82.04 54.34 2.47 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.613 1.097 . . . . 0.0 111.918 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.6 t -157.94 151.37 23.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.764 1.626 . . . . 0.0 111.867 -175.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -47.96 -31.43 5.26 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.149 1.78 . . . . 0.0 115.312 -177.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -82.83 1.58 38.47 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -145.64 17.8 1.48 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 126.264 1.826 . . . . 0.0 113.625 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -64.34 -25.7 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.643 1.719 . . . . 0.0 115.643 -171.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.96 -20.13 20.27 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.546 1.538 . . . . 0.0 111.859 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.43 HG21 ' HB2' ' A' ' 38' ' ' PRO . 2.4 mm -70.43 -38.22 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 O-C-N 121.285 -0.884 . . . . 0.0 109.685 163.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -52.96 -43.44 66.38 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.071 0.948 . . . . 0.0 110.66 173.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -57.4 -39.98 77.27 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.613 1.565 . . . . 0.0 113.944 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.29 -47.02 82.55 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.307 1.412 . . . . 0.0 111.765 169.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.12 -32.99 72.77 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 120.037 1.29 . . . . 0.0 113.21 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -62.17 -50.31 72.36 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.374 1.443 . . . . 0.0 110.92 169.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . 0.255 0.0 OUTLIER -71.69 -31.13 66.43 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -173.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -52.37 -43.89 64.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.105 0.866 . . . . 0.0 110.87 165.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.38 -38.59 74.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.936 0.895 . . . . 0.0 111.945 -178.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.84 -34.18 77.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.832 1.253 . . . . 0.0 112.339 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -93.0 -11.93 31.93 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 174.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.35 -54.14 13.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.084 1.311 . . . . 0.0 110.166 165.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -70.07 -22.19 63.08 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 175.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.96 -60.67 5.86 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.316 2.388 . . . . 0.0 114.418 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.75 60.82 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.568 1.184 . . . . 0.0 113.386 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 171.098 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.2 tpp . . . . . 0 N--CA 1.484 1.271 0 CA-C-O 121.576 0.703 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.1 m -68.06 -22.29 64.95 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 119.417 -2.052 . . . . 0.0 113.68 -169.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -55.4 -37.88 68.17 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.402 -0.811 . . . . 0.0 112.414 175.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -10.92 60.09 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -88.83 -36.7 15.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.115 1.366 . . . . 0.0 111.92 172.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER -80.19 -24.28 40.41 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.42 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -73.5 -30.2 62.97 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.371 0.987 . . . . 0.0 112.791 175.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -73.38 -33.03 64.82 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.952 -1.093 . . . . 0.0 112.971 171.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.15 -36.72 83.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.505 0.722 . . . . 0.0 112.614 169.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -59.48 -44.54 93.03 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.376 -0.827 . . . . 0.0 110.544 168.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.11 -50.53 58.83 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.556 0.598 . . . . 0.0 113.384 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -61.49 -40.71 95.54 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 118.432 1.116 . . . . 0.0 112.011 177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -64.14 -36.94 85.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.388 1.075 . . . . 0.0 112.383 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.5 mt -69.8 -39.02 76.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.341 1.057 . . . . 0.0 112.114 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 51.1 m-85 -61.49 -28.51 69.35 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 118.932 0.787 . . . . 0.0 112.533 167.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.8 -7.34 54.2 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -110.98 -31.32 7.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.953 1.301 . . . . 0.0 112.859 172.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 114.8 9.15 14.48 Favored Glycine 0 N--CA 1.476 1.31 0 C-N-CA 124.216 0.912 . . . . 0.0 114.474 -178.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.84 54.87 3.04 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.994 1.717 . . . . 0.0 110.293 176.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -57.23 -34.51 68.65 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.008 0.923 . . . . 0.0 113.26 -171.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.23 -32.76 56.06 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 120.311 1.414 . . . . 0.0 111.845 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -72.92 -32.97 65.68 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 118.668 0.667 . . . . 0.0 111.969 168.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -67.45 -41.03 85.37 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.905 -1.122 . . . . 0.0 112.298 173.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.4 t -62.02 -39.74 84.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.545 1.138 . . . . 0.0 110.89 168.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -56.91 -32.47 65.96 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.314 0.961 . . . . 0.0 112.369 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.7 m -71.71 -39.74 69.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.259 -0.877 . . . . 0.0 113.295 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -38.71 75.05 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 120.301 1.409 . . . . 0.0 111.081 172.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -61.13 -32.17 71.87 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.107 1.363 . . . . 0.0 111.855 177.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -60.99 -40.08 92.11 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.671 1.123 . . . . 0.0 112.072 171.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.22 -42.8 88.2 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.774 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.1 mt -76.18 -22.52 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.123 0.969 . . . . 0.0 111.188 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 55.6 m -67.96 -41.92 81.68 Favored 'General case' 0 N--CA 1.478 0.933 0 O-C-N 119.891 -1.756 . . . . 0.0 111.222 172.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.32 -20.9 26.13 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.83 65.22 37.76 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.655 1.582 . . . . 0.0 110.809 -172.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -61.93 -22.95 75.31 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.581 2.854 . . . . 0.0 117.27 -164.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -123.33 10.68 9.28 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.42 1.488 . . . . 0.0 111.27 -170.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -90.64 131.77 36.94 Favored Pre-proline 0 CA--C 1.544 0.737 0 O-C-N 120.574 -1.329 . . . . 0.0 111.292 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -63.75 -17.46 60.01 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.683 2.255 . . . . 0.0 114.065 177.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.7 p -53.55 -42.67 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-N 119.028 0.831 . . . . 0.0 111.926 170.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -68.55 -37.97 85.81 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.18 -0.95 . . . . 0.0 111.624 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -69.84 -35.24 74.6 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.556 0.742 . . . . 0.0 112.64 175.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 39.6 t -61.26 -36.77 80.92 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 121.073 -1.017 . . . . 0.0 112.469 170.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -77.97 -28.49 49.43 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.513 0.725 . . . . 0.0 112.57 175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -68.17 -41.94 80.74 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.873 1.215 . . . . 0.0 111.65 166.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.07 81.44 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.119 -0.988 . . . . 0.0 112.404 173.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -61.53 -49.41 76.82 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.269 1.028 . . . . 0.0 111.457 169.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.3 -40.57 82.35 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.258 0.623 . . . . 0.0 112.221 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.3 mt -62.08 -42.85 99.63 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.894 0.878 . . . . 0.0 112.598 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.14 -20.73 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 CA-C-N 119.55 1.068 . . . . 0.0 113.123 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.24 -8.27 56.99 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.604 1.162 . . . . 0.0 114.061 172.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.4 7.79 21.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.68 1.992 . . . . 0.0 112.735 170.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.16 17.98 79.65 Favored Glycine 0 CA--C 1.535 1.343 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 174.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -104.28 52.83 0.75 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.848 1.659 . . . . 0.0 110.75 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.64 -29.89 64.94 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.101 1.36 . . . . 0.0 112.683 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 m -62.99 -27.67 69.57 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.679 0.792 . . . . 0.0 112.506 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -77.02 -40.86 44.99 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.176 0.898 . . . . 0.0 111.299 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.09 93.22 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.385 -0.822 . . . . 0.0 113.005 -175.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.7 pt -63.88 -30.66 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.2 tm0? -78.24 -45.56 22.61 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.858 0.863 . . . . 0.0 111.6 171.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.9 ttm -65.13 -28.87 69.72 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.162 -0.961 . . . . 0.0 113.083 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.9 m -66.42 -39.93 89.25 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 120.99 -1.069 . . . . 0.0 112.295 172.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -62.71 -45.73 91.37 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.036 0.835 . . . . 0.0 110.391 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.99 -37.06 68.61 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 174.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.87 -23.65 59.32 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 120.224 1.375 . . . . 0.0 115.066 177.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.7 mt -65.74 -18.93 65.68 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.57 1.685 . . . . 0.0 112.416 171.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -72.14 5.01 3.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.443 1.497 . . . . 0.0 114.829 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -121.35 44.18 2.61 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.475 1.91 . . . . 0.0 111.037 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.0 p -132.13 -2.19 3.6 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -164.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 81.6 p -63.93 -15.85 60.1 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 118.0 2.593 . . . . 0.0 118.0 -164.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 p -120.17 165.97 14.06 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 120.586 1.539 . . . . 0.0 113.7 -173.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.82 -0.86 1.64 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.1 1.36 . . . . 0.0 114.594 174.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -83.32 -17.63 41.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.91 1.284 . . . . 0.0 112.344 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -129.98 15.09 5.78 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.492 1.517 . . . . 0.0 114.203 -166.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.54 -30.34 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 120.494 -1.379 . . . . 0.0 112.32 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.55 -38.81 81.11 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.176 -0.953 . . . . 0.0 112.086 171.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.2 mm -61.56 -37.93 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.593 1.157 . . . . 0.0 110.687 174.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.09 -44.37 96.81 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.607 1.163 . . . . 0.0 112.619 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 t -63.78 -48.54 76.52 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.015 0.926 . . . . 0.0 111.892 167.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.3 ttpt -58.0 -44.43 87.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 112.939 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.05 -24.47 51.98 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.779 1.172 . . . . 0.0 113.794 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.96 -34.2 59.81 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 120.278 1.399 . . . . 0.0 113.459 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -35.37 58.59 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.116 0.871 . . . . 0.0 111.647 168.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -57.76 -40.58 80.1 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.039 1.29 . . . . 0.0 111.659 171.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -65.69 -41.76 92.0 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.933 0.893 . . . . 0.0 112.874 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.817 0.847 . . . . 0.0 111.017 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -83.21 -20.03 35.37 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.77 -50.88 65.07 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.925 1.239 . . . . 0.0 110.329 164.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -61.86 -28.25 69.36 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.927 0.891 . . . . 0.0 111.964 171.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.24 -55.68 17.47 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 127.535 2.493 . . . . 0.0 112.591 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.49 -33.69 76.52 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.986 1.714 . . . . 0.0 112.56 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.3 p -82.97 -41.79 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 175.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -87.89 -20.38 50.48 Favored Glycine 0 CA--C 1.533 1.157 0 N-CA-C 116.046 1.179 . . . . 0.0 116.046 -169.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.7 m -74.26 145.91 43.65 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 118.944 1.372 . . . . 0.0 111.906 178.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 35.4 m -129.66 -6.79 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.533 1.533 . . . . 0.0 113.181 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . 0.302 16.1 tm0? 64.09 -6.45 0.26 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 128.61 2.764 . . . . 0.0 116.844 176.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mt -82.79 116.2 62.71 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 124.19 0.996 . . . . 0.0 110.1 172.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -84.66 -15.59 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.679 2.92 . . . . 0.0 113.673 175.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 t 61.99 18.08 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 126.406 1.882 . . . . 0.0 114.763 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.9 m -150.22 155.9 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 127.832 2.453 . . . . 0.0 109.567 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 54.31 -157.0 0.2 Allowed 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 125.307 1.443 . . . . 0.0 114.002 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.4 m -139.63 20.94 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 125.283 1.433 . . . . 0.0 113.814 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -65.87 -41.27 91.83 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.27 1.428 . . . . 0.0 113.073 -170.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -130.35 -74.9 0.54 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.518 -0.739 . . . . 0.0 111.269 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 58.5 mt 61.38 158.51 0.11 Allowed Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 127.231 2.212 . . . . 0.0 115.246 -176.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -62.6 168.77 9.43 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.485 2.123 . . . . 0.0 111.542 152.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -68.12 138.15 55.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 112.491 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 73.14 -113.55 4.36 Favored Glycine 0 CA--C 1.531 1.072 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -166.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 28.6 t80 61.36 -69.74 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.108 2.563 . . . . 0.0 115.491 -177.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -140.49 21.54 2.37 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -170.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -134.29 33.31 3.34 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 C--O 1.25 1.108 0 C-N-CA 126.576 1.95 . . . . 0.0 111.097 179.374 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.5 mpt? . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -109.7 149.31 29.93 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.912 0.885 . . . . 0.0 112.176 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -150.33 108.7 3.78 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.528 1.531 . . . . 0.0 108.891 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 74.7 t 65.84 132.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 126.274 1.83 . . . . 0.0 115.017 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 . . . . . 0 C--O 1.256 1.416 0 C-N-CA 126.46 1.904 . . . . 0.0 114.158 -166.024 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 111.362 0.134 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -59.53 -30.07 68.33 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 -168.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -65.37 -30.02 70.8 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.5 1.5 . . . . 0.0 112.608 176.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.61 -30.88 66.29 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.103 -0.998 . . . . 0.0 112.527 177.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -70.45 -28.12 64.77 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.034 1.734 . . . . 0.0 112.48 165.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.34 -45.61 17.49 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.742 0.817 . . . . 0.0 112.9 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -66.28 -27.17 67.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.882 1.219 . . . . 0.0 112.858 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -64.01 -45.93 86.75 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.604 1.093 . . . . 0.0 111.571 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.77 -34.78 60.27 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.17 -39.8 71.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.958 1.254 . . . . 0.0 111.649 175.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.97 -35.26 91.77 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 120.925 -1.109 . . . . 0.0 112.714 170.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -62.23 -40.46 96.21 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 121.127 -1.219 . . . . 0.0 112.111 169.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.3 t -63.23 -35.85 81.69 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.513 -0.742 . . . . 0.0 112.151 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.4 mt -65.98 -36.93 84.65 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 120.606 -1.308 . . . . 0.0 112.482 172.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.73 -33.56 76.15 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.651 1.114 . . . . 0.0 112.228 167.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.9 -2.28 17.39 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.573 1.549 . . . . 0.0 114.598 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -113.28 -50.74 2.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.495 1.918 . . . . 0.0 112.35 175.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.3 0.23 3.41 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.863 1.22 . . . . 0.0 115.34 -176.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -85.33 51.99 2.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.749 2.42 . . . . 0.0 111.319 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.88 -33.57 70.64 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.987 1.315 . . . . 0.0 113.15 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.4 mpt_? -68.7 -47.11 67.22 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.927 1.24 . . . . 0.0 110.351 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -68.41 -36.58 79.31 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.325 0.39 . . . . 0.0 111.41 176.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.16 77.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.318 0.647 . . . . 0.0 112.62 176.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 70.2 t -62.43 -37.28 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.674 0.79 . . . . 0.0 110.77 174.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -61.02 -39.2 88.85 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 119.037 0.835 . . . . 0.0 112.651 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.0 m -66.04 -40.96 91.41 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.44 0.696 . . . . 0.0 112.199 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -68.4 -37.31 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.609 -0.682 . . . . 0.0 112.485 176.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -63.56 -26.14 68.56 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 171.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -76.69 -26.89 55.24 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.746 1.157 . . . . 0.0 113.52 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -62.0 -31.2 71.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.096 0.862 . . . . 0.0 110.491 170.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.2 mt -79.75 -41.93 22.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 124.461 1.105 . . . . 0.0 111.652 173.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 52.3 m -52.51 -42.3 64.2 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 120.694 1.588 . . . . 0.0 112.057 174.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -24.59 53.88 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -140.42 57.43 8.68 Favored Pre-proline 0 CA--C 1.558 1.281 0 C-N-CA 125.179 1.392 . . . . 0.0 112.781 -169.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -64.31 -23.95 65.34 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.383 2.055 . . . . 0.0 115.731 -166.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -95.15 -14.07 24.48 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.535 1.134 . . . . 0.0 112.375 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -88.12 128.16 54.68 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-N 119.141 0.882 . . . . 0.0 112.675 -172.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -60.88 -22.79 75.26 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 122.641 2.227 . . . . 0.0 114.05 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.7 -30.77 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 125.4 1.48 . . . . 0.0 113.607 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.53 -35.58 55.53 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.36 -1.462 . . . . 0.0 112.136 174.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -79.72 -33.85 40.54 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.572 1.149 . . . . 0.0 112.489 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.9 p -62.49 -31.08 71.77 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.223 -0.923 . . . . 0.0 112.24 169.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -77.23 -47.04 21.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.41 1.084 . . . . 0.0 111.607 171.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -57.53 -35.56 70.45 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.879 1.672 . . . . 0.0 112.552 176.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.04 89.89 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 169.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 tpt -65.16 -43.25 92.39 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.636 1.175 . . . . 0.0 111.606 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.68 -45.61 93.51 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.654 0.782 . . . . 0.0 112.368 174.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.9 mt -58.6 -41.32 85.55 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.217 0.607 . . . . 0.0 112.404 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.7 pt -73.25 -33.14 40.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-N 118.961 0.8 . . . . 0.0 112.699 175.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -18.16 63.64 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.631 1.173 . . . . 0.0 113.197 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 tt -95.96 -39.6 9.7 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.345 2.258 . . . . 0.0 111.899 179.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 122.16 16.92 3.81 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.614 1.102 . . . . 0.0 115.715 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -103.02 48.4 0.86 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.746 1.619 . . . . 0.0 110.319 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -55.09 -38.1 67.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.665 1.586 . . . . 0.0 112.147 -174.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.6 m -65.97 -20.44 66.2 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 113.285 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -81.62 -40.26 23.23 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.874 -1.141 . . . . 0.0 110.978 169.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.52 -37.95 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.5 pt -62.09 -33.04 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 CA-C-N 118.742 0.701 . . . . 0.0 112.632 175.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.5 tm0? -75.83 -43.94 43.48 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.124 0.569 . . . . 0.0 111.669 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.9 tpp -54.76 -39.04 67.94 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.969 0.804 . . . . 0.0 112.568 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.1 m -60.36 -40.76 91.92 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.196 -0.94 . . . . 0.0 113.018 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -76.12 -28.48 57.48 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.27 1.028 . . . . 0.0 112.482 177.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -32.47 70.47 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.851 0.86 . . . . 0.0 112.245 166.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.57 -25.45 60.81 Favored Glycine 0 CA--C 1.536 1.364 0 O-C-N 120.321 -1.487 . . . . 0.0 113.942 174.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.86 -21.33 28.54 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.33 1.565 . . . . 0.0 112.958 166.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 58.9 mtt180 -72.31 4.23 3.9 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 125.556 1.542 . . . . 0.0 115.032 174.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -124.09 29.09 6.54 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 127.468 2.307 . . . . 0.0 111.947 -176.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -127.0 12.12 7.16 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 -163.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 91.1 p -71.55 -7.48 47.89 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 116.506 2.039 . . . . 0.0 116.506 -169.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.7 t -132.86 157.12 45.84 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.016 1.726 . . . . 0.0 112.135 -172.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -48.65 -33.07 9.29 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.339 1.855 . . . . 0.0 112.84 173.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -55.94 -19.45 12.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.448 1.499 . . . . 0.0 114.065 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.8 m-70 -131.79 17.07 4.73 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.185 2.194 . . . . 0.0 112.453 -175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.5 p -71.96 -32.47 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 O-C-N 120.066 -1.646 . . . . 0.0 112.891 -178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.68 -35.32 70.24 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.239 -0.913 . . . . 0.0 111.405 171.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.1 mm -59.84 -37.37 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 125.988 1.715 . . . . 0.0 112.108 168.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -58.5 -33.61 70.01 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-N 119.401 1.0 . . . . 0.0 112.469 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -77.86 -41.59 36.29 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.699 0.8 . . . . 0.0 112.774 167.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -66.34 -16.99 64.5 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 -175.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -92.83 -36.64 12.73 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.933 1.242 . . . . 0.0 114.051 161.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -73.1 -30.99 64.05 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 120.773 1.624 . . . . 0.0 113.727 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.29 -31.17 63.89 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 119.592 1.087 . . . . 0.0 111.531 167.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -63.48 -34.13 77.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.121 -0.987 . . . . 0.0 111.807 174.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.74 -44.35 96.42 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.111 0.964 . . . . 0.0 112.079 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -68.7 -33.05 73.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.868 1.267 . . . . 0.0 111.943 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.36 -14.51 46.17 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 174.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.85 -46.27 65.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.905 1.684 . . . . 0.0 111.194 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -74.11 -6.49 47.95 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.75 -49.77 6.36 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.592 1.568 . . . . 0.0 113.66 162.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.89 -27.48 68.24 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.028 2.131 . . . . 0.0 113.69 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.76 -19.45 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.357 1.063 . . . . 0.0 112.569 169.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.96 -159.07 43.28 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 125.839 1.685 . . . . 0.0 113.765 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.5 m 60.82 27.73 17.52 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.993 1.317 . . . . 0.0 114.347 176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.8 t -75.15 150.09 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 125.302 1.441 . . . . 0.0 112.396 -173.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -130.51 -179.86 5.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.718 2.007 . . . . 0.0 113.633 -175.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mt 55.31 57.35 10.85 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.551 2.34 . . . . 0.0 112.69 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.35 3.76 3.9 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.056 2.504 . . . . 0.0 114.52 -178.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.484 HG12 ' H ' ' A' ' 99' ' ' VAL . 1.8 t 54.54 -143.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 125.115 1.366 . . . . 0.0 109.561 -164.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.484 ' H ' HG12 ' A' ' 98' ' ' VAL . 3.2 t 55.49 51.4 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 126.124 1.77 . . . . 0.0 112.476 170.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 67.31 -53.75 0.48 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 128.387 2.675 . . . . 0.0 116.981 162.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 31.0 m -149.78 1.43 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.719 1.608 . . . . 0.0 113.597 -167.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -66.73 -34.1 77.11 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -157.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -151.23 -70.2 0.17 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.221 1.009 . . . . 0.0 109.185 159.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.8 mt 62.97 152.12 0.11 Allowed Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 127.952 2.501 . . . . 0.0 115.928 170.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.74 123.41 8.5 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.82 2.347 . . . . 0.0 111.28 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 50.15 23.64 1.21 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 126.832 2.053 . . . . 0.0 115.787 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.35 54.8 31.67 Favored Glycine 0 CA--C 1.531 1.051 0 O-C-N 120.897 -1.127 . . . . 0.0 113.035 -171.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -45.26 -41.72 8.85 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.956 2.103 . . . . 0.0 115.697 -173.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.35 4.7 52.07 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.803 1.183 . . . . 0.0 113.862 -171.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -61.28 151.98 30.37 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.041 -1.037 . . . . 0.0 111.169 167.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 70.9 m . . . . . 0 C--O 1.255 1.353 0 C-N-CA 124.738 1.215 . . . . 0.0 113.042 -178.301 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 19.9 mmt . . . . . 0 N--CA 1.48 1.056 0 CA-C-O 118.871 -0.585 . . . . 0.0 111.994 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 50.1 49.48 20.33 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.711 1.204 . . . . 0.0 112.856 -174.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -118.59 166.79 12.3 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 120.862 -1.149 . . . . 0.0 112.884 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 95.8 t -23.8 122.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 130.213 3.405 . . . . 0.0 114.044 172.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 35.8 t70 . . . . . 0 C--O 1.251 1.159 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 -160.987 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.2 mtp . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 p -64.8 -37.03 86.24 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.73 -41.11 99.01 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.154 0.888 . . . . 0.0 111.349 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.15 -38.65 72.23 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.47 -0.769 . . . . 0.0 112.9 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -68.58 -24.51 64.6 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 124.277 1.031 . . . . 0.0 113.379 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -73.53 -63.0 1.29 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.592 1.157 . . . . 0.0 111.378 160.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -60.83 -30.62 70.2 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -163.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -65.55 -37.42 86.65 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.101 0.96 . . . . 0.0 112.942 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -92.41 -31.33 15.34 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.558 1.072 . . . . 0.0 112.122 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -49.37 -39.56 32.56 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.313 1.445 . . . . 0.0 111.674 166.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -52.77 -43.2 60.13 Favored Glycine 0 CA--C 1.537 1.444 0 O-C-N 121.435 -0.791 . . . . 0.0 113.972 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -70.51 -38.78 74.33 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.199 1.499 . . . . 0.0 111.956 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 t -63.72 -31.94 73.28 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.278 1.031 . . . . 0.0 112.502 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.83 -37.59 79.26 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.587 -1.321 . . . . 0.0 112.332 175.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -62.48 -32.61 73.53 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 119.422 1.01 . . . . 0.0 112.245 165.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.0 10.8 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.53 1.932 . . . . 0.0 114.947 174.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -120.54 -44.55 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.781 1.633 . . . . 0.0 110.732 165.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.69 -1.68 3.61 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 125.19 1.376 . . . . 0.0 114.821 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.0 mt -87.26 53.56 2.85 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.466 1.906 . . . . 0.0 111.244 -170.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -53.71 -35.93 61.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.012 1.325 . . . . 0.0 113.36 -173.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -75.21 -33.65 61.4 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.188 0.904 . . . . 0.0 112.176 -179.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -75.44 -29.76 59.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.167 0.894 . . . . 0.0 112.248 168.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.7 -44.55 89.88 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.127 -0.983 . . . . 0.0 111.861 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.9 t -62.83 -42.01 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.928 0.891 . . . . 0.0 111.02 170.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -54.28 -40.37 67.78 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.63 0.65 . . . . 0.0 112.717 175.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 71.9 m -68.97 -38.85 79.63 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 117.891 -1.052 . . . . 0.0 112.952 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.18 -35.68 76.54 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.512 1.506 . . . . 0.0 111.361 172.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.61 -22.3 65.36 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.291 1.036 . . . . 0.0 112.582 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -65.87 -47.92 73.29 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.904 0.775 . . . . 0.0 111.391 167.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -36.76 76.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.123 0.874 . . . . 0.0 110.619 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 55.7 mt -74.55 -21.92 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 119.024 0.829 . . . . 0.0 112.277 177.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.2 m -79.18 -41.66 27.87 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.431 -1.418 . . . . 0.0 111.85 171.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.19 -25.16 29.74 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -177.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -137.99 63.95 39.55 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 125.475 1.51 . . . . 0.0 111.189 -175.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -64.07 -12.1 30.67 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 123.76 2.973 . . . . 0.0 118.567 -165.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -122.08 3.98 9.86 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.037 0.935 . . . . 0.0 112.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -81.0 123.34 82.15 Favored Pre-proline 0 CA--C 1.544 0.742 0 O-C-N 120.391 -1.443 . . . . 0.0 110.329 175.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -63.43 -11.34 25.34 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.364 2.043 . . . . 0.0 114.461 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -53.61 -36.2 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-N 119.034 0.834 . . . . 0.0 112.42 167.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.9 -50.86 16.86 Favored Glycine 0 CA--C 1.53 0.988 0 O-C-N 121.485 -0.76 . . . . 0.0 112.351 177.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -61.65 -40.96 96.76 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.022 0.929 . . . . 0.0 112.587 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.6 p -70.24 -21.64 62.97 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.091 -1.006 . . . . 0.0 113.615 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -78.74 -46.27 19.29 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.684 0.794 . . . . 0.0 111.412 170.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.28 -41.35 84.15 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.969 0.907 . . . . 0.0 112.568 173.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.82 -32.0 70.24 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -68.93 -44.56 72.82 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.627 -0.67 . . . . 0.0 111.127 172.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.18 82.49 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.757 0.823 . . . . 0.0 112.818 177.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.7 mt -64.09 -47.0 81.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.364 0.666 . . . . 0.0 111.582 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.59 -29.48 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 CA-C-N 119.487 1.04 . . . . 0.0 112.991 176.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.21 0.23 33.35 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 177.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -127.33 12.32 7.01 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.636 1.974 . . . . 0.0 113.687 171.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.39 15.79 79.31 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.494 1.357 . . . . 0.0 116.494 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -91.9 44.47 1.17 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.827 1.651 . . . . 0.0 112.452 175.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.0 -37.3 68.95 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.36 1.064 . . . . 0.0 113.03 -175.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 62.4 m -62.46 -30.06 70.98 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.88 1.272 . . . . 0.0 112.52 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -87.38 -29.32 21.6 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.001 0.52 . . . . 0.0 111.149 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.29 -41.4 73.4 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.306 1.042 . . . . 0.0 113.059 178.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.8 pt -60.64 -34.45 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.138 0.881 . . . . 0.0 112.029 176.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -68.43 -51.49 43.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.587 0.755 . . . . 0.0 111.373 170.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.88 -29.29 70.49 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -66.65 -43.59 84.2 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.044 -1.035 . . . . 0.0 111.998 174.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -67.99 -36.95 80.87 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.724 0.693 . . . . 0.0 111.563 175.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.62 -32.88 73.04 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.3 -0.875 . . . . 0.0 112.845 168.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -78.09 -23.33 66.43 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 120.493 -1.38 . . . . 0.0 114.402 176.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.47 -20.02 65.94 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.499 1.65 . . . . 0.0 112.944 171.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -65.92 -5.45 9.34 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.529 1.532 . . . . 0.0 114.58 169.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -122.37 50.25 1.5 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.913 2.085 . . . . 0.0 110.664 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -136.17 4.27 2.94 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m -67.09 -29.98 69.9 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -164.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.2 p -113.1 166.27 11.58 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.115 1.366 . . . . 0.0 112.668 -169.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.01 -30.83 64.53 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -173.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.06 16.42 0.16 Allowed 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.827 1.788 . . . . 0.0 115.827 176.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -133.18 10.26 4.14 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.485 1.514 . . . . 0.0 113.577 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.4 m -63.77 -30.26 49.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 O-C-N 120.503 -1.373 . . . . 0.0 114.123 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.9 -37.23 24.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.734 0.697 . . . . 0.0 111.24 173.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.2 mm -55.29 -43.98 73.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.336 1.055 . . . . 0.0 111.293 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 49.8 ttp85 -60.32 -40.12 89.45 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.082 0.953 . . . . 0.0 112.046 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.1 m -66.75 -46.54 75.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.04 0.936 . . . . 0.0 112.678 170.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -51.73 -57.52 9.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.171 0.896 . . . . 0.0 111.394 177.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -67.22 -28.24 67.91 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.825 1.193 . . . . 0.0 113.562 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -74.3 -45.89 44.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.848 1.204 . . . . 0.0 112.81 174.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.15 -33.21 73.06 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.039 1.29 . . . . 0.0 111.646 176.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.9 mmt-85 -55.65 -36.96 67.61 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.42 1.009 . . . . 0.0 112.064 171.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 20.1 tp -70.01 -44.14 69.92 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 119.142 0.883 . . . . 0.0 111.92 178.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -63.96 -30.29 71.38 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.047 0.939 . . . . 0.0 112.983 172.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.89 -20.22 23.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.56 72.89 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.778 1.626 . . . . 0.0 110.327 168.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -69.56 -16.67 63.46 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 171.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.71 -52.22 7.39 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 125.627 1.584 . . . . 0.0 113.382 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.4 -36.41 66.02 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.598 1.559 . . . . 0.0 112.444 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.6 p -65.26 -31.72 55.11 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.353 0.661 . . . . 0.0 112.212 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 62.47 -95.77 0.13 Allowed Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.431 1.015 . . . . 0.0 113.096 -175.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.2 m -62.68 151.38 38.44 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.092 1.757 . . . . 0.0 114.83 -168.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -75.77 35.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 126.244 1.818 . . . . 0.0 113.148 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 -1.19 56.73 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.398 1.879 . . . . 0.0 113.879 -165.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.7 mp -127.72 79.82 72.96 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.471 1.509 . . . . 0.0 109.274 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -89.13 -11.2 3.75 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.489 2.793 . . . . 0.0 113.425 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.5 t 56.45 34.55 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 126.654 1.982 . . . . 0.0 114.144 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 40.9 t -140.44 108.46 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.818 1.247 . . . . 0.0 111.862 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 48.4 -107.3 0.21 Allowed 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.822 2.156 . . . . 0.0 116.822 162.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 21.2 t -142.74 117.43 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 125.507 1.523 . . . . 0.0 111.537 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -165.82 -77.5 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 126.477 1.911 . . . . 0.0 109.304 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -147.46 112.98 5.63 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.523 2.329 . . . . 0.0 107.489 165.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 mp -143.08 167.13 16.8 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.808 2.043 . . . . 0.0 111.31 -168.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -54.6 160.87 6.53 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.421 2.748 . . . . 0.0 114.573 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -58.0 144.45 39.61 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.128 1.371 . . . . 0.0 111.914 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.62 -14.98 0.67 Allowed Glycine 0 CA--C 1.538 1.498 0 N-CA-C 116.605 1.402 . . . . 0.0 116.605 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -67.51 121.19 15.29 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.785 1.793 . . . . 0.0 110.572 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 t70 60.93 10.44 2.78 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.716 2.006 . . . . 0.0 115.115 -170.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.39 141.84 48.14 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.364 1.466 . . . . 0.0 112.342 -168.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.251 1.139 0 C-N-CA 126.695 1.998 . . . . 0.0 113.922 -173.406 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 21.1 mmt . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 121.327 0.584 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -134.21 38.13 3.15 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.706 1.202 . . . . 0.0 112.241 172.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -75.62 41.43 0.2 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.555 1.542 . . . . 0.0 113.139 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 12.1 p -73.47 -28.61 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -161.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.783 1.633 . . . . 0.0 113.625 -175.8 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 37.1 mtt . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.1 m -57.62 -36.88 72.39 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -63.6 -20.16 65.43 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.731 -1.231 . . . . 0.0 113.588 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.47 -15.49 49.33 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 172.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -74.17 -52.19 13.24 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 157.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -52.08 -39.8 60.27 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.265 1.026 . . . . 0.0 112.5 -176.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -72.27 -28.34 63.05 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.8 ptpp? -81.79 -34.65 30.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.218 1.372 . . . . 0.0 112.708 173.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -75.94 -41.06 52.77 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.123 0.969 . . . . 0.0 111.222 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -59.82 -39.4 84.93 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.867 0.867 . . . . 0.0 111.275 167.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.18 -50.62 51.11 Favored Glycine 0 CA--C 1.534 1.274 0 CA-C-N 119.108 0.867 . . . . 0.0 112.477 177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -66.24 -40.81 90.5 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.315 1.057 . . . . 0.0 111.601 177.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 t -57.52 -43.11 84.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.421 1.088 . . . . 0.0 112.668 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.7 mt -67.2 -35.61 79.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.92 1.288 . . . . 0.0 112.142 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -70.3 -28.13 64.94 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 172.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.86 -14.34 61.47 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.283 1.033 . . . . 0.0 112.79 171.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -98.63 -53.87 3.19 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.873 1.269 . . . . 0.0 112.793 176.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 135.65 14.95 0.99 Allowed Glycine 0 CA--C 1.537 1.46 0 N-CA-C 115.364 0.906 . . . . 0.0 115.364 -172.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.0 mt -101.61 58.01 0.85 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.285 1.834 . . . . 0.0 110.21 -177.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.99 -36.82 85.24 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.8 1.24 . . . . 0.0 113.499 -168.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.63 -33.19 27.95 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.227 0.921 . . . . 0.0 111.279 -177.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -63.49 -39.99 95.89 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 118.15 0.432 . . . . 0.0 110.558 167.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.55 -45.88 77.95 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.491 -0.755 . . . . 0.0 112.757 175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.2 t -59.06 -35.43 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.199 173.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -61.12 -44.75 96.85 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 119.857 1.208 . . . . 0.0 112.166 172.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 82.0 m -60.14 -39.94 88.11 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.841 0.856 . . . . 0.0 112.674 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -75.0 -38.14 61.68 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 175.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -62.49 -32.21 73.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.264 0.938 . . . . 0.0 111.452 172.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -69.36 -26.73 64.82 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.85 1.056 . . . . 0.0 113.85 174.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.49 -42.6 78.59 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.988 1.267 . . . . 0.0 110.552 166.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.6 mt -80.93 -21.39 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.022 1.329 . . . . 0.0 111.642 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.1 m -66.29 -44.38 83.67 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.241 -1.537 . . . . 0.0 110.735 168.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.77 -19.9 31.88 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.867 1.267 . . . . 0.0 114.355 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -141.45 68.6 26.05 Favored Pre-proline 0 CA--C 1.556 1.181 0 C-N-CA 125.49 1.516 . . . . 0.0 111.143 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -67.18 -22.01 47.55 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.866 2.378 . . . . 0.0 117.037 -167.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.2 tp60 -100.18 -27.12 13.68 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.616 1.166 . . . . 0.0 111.794 -176.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -69.51 138.18 88.68 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 123.865 0.866 . . . . 0.0 112.872 -171.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.28 -20.83 62.18 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.909 2.406 . . . . 0.0 113.935 178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.8 p -46.22 -59.79 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 125.244 1.418 . . . . 0.0 112.222 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.51 -34.86 85.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 118.95 -0.917 . . . . 0.0 113.432 -172.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -62.62 -42.4 99.57 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.897 1.349 . . . . 0.0 111.285 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 20.7 p -67.06 -25.44 66.25 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 177.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -85.19 -38.82 18.53 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.931 0.892 . . . . 0.0 112.056 172.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -63.32 -31.29 72.4 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.1 -1.625 . . . . 0.0 112.173 173.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.26 -38.61 84.04 Favored 'General case' 0 CA--C 1.548 0.904 0 O-C-N 121.007 -1.058 . . . . 0.0 113.364 169.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 6.6 tpt -64.12 -43.46 95.2 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.74 0.816 . . . . 0.0 111.17 173.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.07 -44.96 79.43 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.334 0.654 . . . . 0.0 111.878 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.75 -38.93 92.49 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.503 -0.748 . . . . 0.0 112.751 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.4 pt -75.79 -25.86 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 CA-C-N 120.111 1.323 . . . . 0.0 113.831 174.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -19.96 39.11 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.913 1.285 . . . . 0.0 113.143 175.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 tt -80.41 -43.52 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.687 1.595 . . . . 0.0 109.854 165.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.79 32.36 4.47 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 124.242 0.925 . . . . 0.0 113.802 -175.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -101.71 57.42 0.83 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.761 1.624 . . . . 0.0 109.232 171.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -59.33 -35.05 73.11 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.494 -0.754 . . . . 0.0 111.917 -170.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 88.4 m -62.08 -29.91 70.64 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.114 0.966 . . . . 0.0 112.785 174.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -81.57 -34.54 31.01 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 111.453 171.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.37 -41.36 98.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.24 -0.913 . . . . 0.0 112.881 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.9 pt -64.33 -30.44 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.299 0.639 . . . . 0.0 112.681 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -71.08 -51.21 26.52 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.475 0.71 . . . . 0.0 110.767 170.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.6 ttm -63.51 -34.04 76.9 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -175.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.3 m -69.76 -42.64 73.58 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.17 -0.956 . . . . 0.0 112.053 175.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.17 -37.16 80.68 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 119.011 0.823 . . . . 0.0 112.078 177.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -39.92 92.53 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.332 1.053 . . . . 0.0 111.867 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.41 -23.92 77.49 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.229 -1.544 . . . . 0.0 114.233 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.2 mt -66.93 -25.75 66.51 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.959 1.379 . . . . 0.0 112.348 169.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -59.78 -48.34 82.06 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.142 0.883 . . . . 0.0 111.24 170.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -64.24 -28.1 69.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.255 1.022 . . . . 0.0 113.351 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.5 p -118.64 -1.4 11.15 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -158.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -78.68 49.79 0.92 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.579 1.152 . . . . 0.0 112.825 177.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 t -157.46 153.46 27.16 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.622 1.569 . . . . 0.0 112.025 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.06 -35.59 25.8 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -164.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -80.52 -2.82 47.67 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -133.62 12.26 4.08 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.957 1.703 . . . . 0.0 113.098 -173.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 26.8 m -62.49 -24.86 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.74 -37.22 59.53 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.427 1.012 . . . . 0.0 111.133 171.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mm -65.6 -33.86 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 124.284 1.033 . . . . 0.0 111.186 173.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -57.41 -44.5 84.65 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.909 1.284 . . . . 0.0 111.401 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 m -66.55 -34.5 78.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.923 0.889 . . . . 0.0 112.56 170.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -68.9 -0.6 5.75 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 170.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.98 -33.39 6.93 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 117.522 -1.228 . . . . 0.0 113.405 156.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -54.6 -54.64 38.69 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 121.238 1.835 . . . . 0.0 112.092 173.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -30.17 67.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 122.08 -0.388 . . . . 0.0 111.452 -172.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -64.83 -40.3 94.96 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.35 -0.844 . . . . 0.0 111.563 170.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.57 -30.75 68.61 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.968 0.907 . . . . 0.0 112.159 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -68.69 -47.45 66.41 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.006 0.523 . . . . 0.0 112.063 165.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.88 -16.09 62.67 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.095 -1.003 . . . . 0.0 113.694 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.46 93.1 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.437 1.471 . . . . 0.0 111.327 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.58 -27.47 65.14 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 121.47 0.652 . . . . 0.0 112.038 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.67 -47.15 42.61 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.349 1.452 . . . . 0.0 112.782 177.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -79.17 -32.68 44.3 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.02 1.728 . . . . 0.0 113.218 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.9 p -71.41 -33.2 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 CA-C-N 118.953 0.797 . . . . 0.0 111.112 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.4 21.44 4.37 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 125.484 1.516 . . . . 0.0 114.661 171.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.4 m -125.73 20.74 7.77 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.342 1.457 . . . . 0.0 113.582 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.8 m -90.72 142.35 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.863 0.865 . . . . 0.0 112.097 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -109.75 177.89 4.59 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 125.681 1.592 . . . . 0.0 112.714 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 13.1 mt 66.93 86.86 0.12 Allowed Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 126.796 2.038 . . . . 0.0 110.189 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -71.41 -15.97 31.06 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.185 1.923 . . . . 0.0 113.413 175.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 t 65.46 46.56 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 125.276 1.43 . . . . 0.0 112.023 179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 28.8 m -133.61 170.78 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.908 1.283 . . . . 0.0 112.12 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -78.82 -36.16 43.0 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.681 0.792 . . . . 0.0 112.536 178.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -138.47 125.73 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 122.034 0.921 . . . . 0.0 112.882 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.69 -135.37 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.978 2.511 . . . . 0.0 106.545 160.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -87.53 -39.52 15.07 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.354 1.434 . . . . 0.0 111.103 171.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.8 mt 62.4 143.03 0.06 OUTLIER Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 129.46 3.104 . . . . 0.0 114.856 166.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.94 122.94 6.02 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.69 2.26 . . . . 0.0 111.644 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 46.29 42.07 9.84 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.068 1.347 . . . . 0.0 112.767 -174.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.77 -43.2 2.57 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.821 1.677 . . . . 0.0 116.013 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 56.0 t80 59.16 -41.45 0.07 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 128.433 2.693 . . . . 0.0 117.055 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -133.29 121.16 22.01 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.902 2.081 . . . . 0.0 110.073 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mmt-85 -143.81 154.82 43.81 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.807 1.643 . . . . 0.0 110.988 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 72.5 m . . . . . 0 C--O 1.247 0.961 0 C-N-CA 126.127 1.771 . . . . 0.0 111.973 176.663 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.13 166.86 11.2 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.872 2.069 . . . . 0.0 114.318 -167.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.62 154.0 51.71 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.355 1.862 . . . . 0.0 110.674 163.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.98 139.13 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 O-C-N 121.063 -1.023 . . . . 0.0 113.55 -172.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.642 2.377 . . . . 0.0 110.214 172.123 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.754 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.9 p -121.78 -16.39 7.67 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -173.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -64.0 -30.5 71.57 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 121.409 1.913 . . . . 0.0 112.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -13.2 59.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 174.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -77.81 -48.33 16.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 120.96 -1.087 . . . . 0.0 108.636 163.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -46.74 65.04 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.256 1.022 . . . . 0.0 111.974 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -66.92 -25.96 66.62 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.5 ptpp? -86.95 -30.97 20.91 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.987 1.267 . . . . 0.0 113.589 174.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -76.92 -31.85 56.95 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 118.968 0.803 . . . . 0.0 111.185 173.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -57.66 -52.62 64.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.624 1.57 . . . . 0.0 110.776 159.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.13 -45.97 71.59 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 119.175 0.898 . . . . 0.0 113.746 176.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -56.86 -52.09 66.47 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.936 1.294 . . . . 0.0 111.479 173.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.4 m -60.15 -47.88 84.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.9 0.88 . . . . 0.0 111.379 -178.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -55.71 -35.65 66.32 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.727 1.211 . . . . 0.0 112.044 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -66.48 -41.66 88.64 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 120.069 1.304 . . . . 0.0 113.997 173.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -42.19 99.37 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 119.262 0.937 . . . . 0.0 111.833 172.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -72.35 -25.16 61.43 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 110.85 12.88 15.08 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 125.263 1.411 . . . . 0.0 116.055 171.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.2 mt -97.81 61.8 1.59 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 126.93 2.092 . . . . 0.0 111.047 -174.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -59.26 -30.52 68.35 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.642 1.177 . . . . 0.0 113.986 -175.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -84.31 -32.24 24.44 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.015 -1.053 . . . . 0.0 111.463 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -65.61 -42.79 91.21 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.665 0.786 . . . . 0.0 110.821 164.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.08 -48.49 70.8 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.479 -0.763 . . . . 0.0 112.405 -177.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 49.6 t -60.34 -33.48 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.574 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -59.68 -43.69 93.9 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.026 1.285 . . . . 0.0 112.592 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 63.3 m -70.3 -34.03 72.24 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.721 -0.612 . . . . 0.0 112.313 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -72.89 -40.2 65.75 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.877 0.871 . . . . 0.0 112.901 172.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -58.76 -36.06 73.78 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.546 1.138 . . . . 0.0 111.263 172.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.33 -14.45 60.1 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.6 mt -63.67 -39.98 95.68 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.13 1.332 . . . . 0.0 110.251 161.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 19.9 mt -75.56 -44.59 40.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 m -60.1 -33.47 72.15 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.771 1.169 . . . . 0.0 112.286 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.39 -22.09 44.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -144.55 61.12 8.28 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.085 1.354 . . . . 0.0 111.802 -170.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -64.99 -20.52 64.05 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.353 2.035 . . . . 0.0 117.164 -158.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -113.27 3.26 15.88 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.074 0.95 . . . . 0.0 112.237 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -82.01 127.12 73.11 Favored Pre-proline 0 CA--C 1.541 0.608 0 O-C-N 120.717 -1.239 . . . . 0.0 111.613 178.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.39 -14.79 44.38 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 122.347 2.031 . . . . 0.0 113.806 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.58 -36.98 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-N 119.739 1.154 . . . . 0.0 112.287 170.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.38 -50.16 28.22 Favored Glycine 0 CA--C 1.529 0.949 0 O-C-N 121.099 -1.0 . . . . 0.0 111.717 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -66.73 -38.56 86.93 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.303 1.041 . . . . 0.0 112.967 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.7 p -69.58 -14.46 62.85 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 173.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -91.81 -41.4 10.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.276 1.031 . . . . 0.0 111.946 168.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -62.37 -36.77 83.3 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 120.793 -1.192 . . . . 0.0 112.396 175.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.76 -35.3 76.05 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.327 -0.858 . . . . 0.0 113.021 170.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.6 tpt -68.85 -41.87 77.88 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.828 0.851 . . . . 0.0 111.657 175.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -46.11 84.02 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.746 0.819 . . . . 0.0 111.286 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 45.6 mt -59.57 -35.82 75.0 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.66 0.784 . . . . 0.0 112.951 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.5 pt -84.07 -17.78 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 114.64 1.348 . . . . 0.0 114.64 174.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.01 -14.92 53.05 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.674 1.19 . . . . 0.0 112.429 168.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.5 tt -94.3 -50.61 5.18 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.924 2.489 . . . . 0.0 111.579 175.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 126.88 15.95 2.51 Favored Glycine 0 CA--C 1.54 1.646 0 N-CA-C 116.4 1.32 . . . . 0.0 116.4 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -105.31 53.69 0.71 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.413 1.485 . . . . 0.0 110.002 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.87 -29.55 69.61 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.032 -1.042 . . . . 0.0 112.998 -173.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.5 m -60.74 -29.8 69.6 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.953 0.797 . . . . 0.0 111.912 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -76.36 -36.33 58.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.106 0.562 . . . . 0.0 111.445 172.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.32 -37.93 74.83 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -177.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.8 pt -65.08 -33.32 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.896 0.771 . . . . 0.0 111.973 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.0 tm0? -68.6 -45.8 71.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.45 0.7 . . . . 0.0 110.818 171.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.9 ttm -73.77 -31.2 63.18 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -173.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 74.9 m -66.76 -39.91 88.04 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.907 -1.121 . . . . 0.0 111.464 173.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -67.48 -37.66 83.23 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.442 -0.786 . . . . 0.0 112.008 173.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.32 -31.93 72.62 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.284 0.634 . . . . 0.0 111.989 171.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.93 -24.56 64.06 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 120.241 1.382 . . . . 0.0 114.391 174.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.4 mt -62.3 -22.16 65.82 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.648 1.724 . . . . 0.0 112.253 169.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.68 -2.44 2.45 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 169.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -120.81 40.59 3.5 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.052 1.741 . . . . 0.0 111.665 -175.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 34.3 p -135.9 7.44 3.21 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 116.857 2.169 . . . . 0.0 116.857 -164.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 95.3 p -83.38 19.05 1.62 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -172.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -142.81 144.62 32.63 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 126.609 1.964 . . . . 0.0 109.61 177.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.79 -9.79 31.65 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.031 0.932 . . . . 0.0 113.465 176.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -59.12 -23.69 62.34 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.399 1.08 . . . . 0.0 112.309 164.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -129.92 24.22 5.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.937 2.095 . . . . 0.0 112.675 -176.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 p -62.06 -34.46 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 O-C-N 119.958 -1.714 . . . . 0.0 111.996 173.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.0 79.49 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.521 -0.737 . . . . 0.0 111.44 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.1 mm -65.13 -37.11 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.43 1.092 . . . . 0.0 111.184 170.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -59.57 -40.21 86.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.702 0.801 . . . . 0.0 111.997 177.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.6 t -70.04 -46.49 64.91 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.218 1.007 . . . . 0.0 112.162 168.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -72.05 -3.95 25.94 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -175.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -101.58 -33.13 10.04 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.064 1.302 . . . . 0.0 113.705 158.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -67.75 -49.71 61.04 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 120.381 1.446 . . . . 0.0 112.723 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -34.17 77.31 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.878 1.217 . . . . 0.0 111.19 174.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -65.04 -31.65 72.99 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.86 -1.15 . . . . 0.0 112.116 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 33.9 tp -71.63 -37.96 70.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.299 1.04 . . . . 0.0 112.774 169.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -62.03 -36.92 83.05 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.757 -0.589 . . . . 0.0 111.438 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.56 -25.49 35.8 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.889 -1.132 . . . . 0.0 113.259 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.72 99.89 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 120.47 1.486 . . . . 0.0 111.408 167.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -64.63 -27.18 68.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.801 0.84 . . . . 0.0 112.211 170.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.52 -46.04 57.09 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 125.688 1.613 . . . . 0.0 113.605 172.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.64 -28.79 61.02 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.6 1.16 . . . . 0.0 113.094 -177.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.7 p -80.44 -24.32 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -94.79 -157.76 32.79 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 124.177 0.894 . . . . 0.0 112.602 171.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 77.7 p -136.42 145.98 45.88 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.871 0.868 . . . . 0.0 112.849 165.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 1.3 t 46.22 37.8 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 126.79 2.036 . . . . 0.0 112.949 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -70.21 115.71 9.72 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.969 1.308 . . . . 0.0 110.525 -171.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.557 ' H ' ' HD3' ' A' ' 105' ' ' PRO . 4.0 mp 56.54 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 126.141 1.776 . . . . 0.0 109.567 -155.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -79.13 -4.19 13.66 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.883 3.055 . . . . 0.0 112.551 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 t 64.53 45.54 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 124.476 1.11 . . . . 0.0 111.826 172.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 17.2 m -140.13 44.25 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.168 2.187 . . . . 0.0 111.059 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 50.07 -136.19 1.23 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.91 1.284 . . . . 0.0 112.032 -172.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 33.6 m -87.63 6.95 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 -168.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -51.14 -40.85 59.47 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.484 1.514 . . . . 0.0 114.191 -173.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -135.84 -58.58 0.76 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.864 1.266 . . . . 0.0 112.554 177.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.4 mt 50.89 163.21 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 128.514 2.726 . . . . 0.0 117.84 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.557 ' HD3' ' H ' ' A' ' 96' ' ' ILE . 68.4 Cg_endo -88.27 -20.9 1.66 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 124.241 3.294 . . . . 0.0 115.236 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -152.31 170.81 19.13 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.832 1.253 . . . . 0.0 111.854 -162.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.8 56.69 0.15 Allowed Glycine 0 CA--C 1.539 1.56 0 C-N-CA 126.316 1.912 . . . . 0.0 113.567 164.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -98.36 175.56 6.01 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.8 2.44 . . . . 0.0 112.171 -169.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.35 45.2 23.28 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.434 1.094 . . . . 0.0 113.338 175.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -75.84 49.6 0.53 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.805 2.042 . . . . 0.0 113.874 -173.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--O 1.253 1.262 0 C-N-CA 127.766 2.427 . . . . 0.0 113.217 -173.357 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -112.02 158.31 19.69 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.006 0.922 . . . . 0.0 113.14 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -142.49 -3.98 1.01 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 -156.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 45.4 t -144.73 132.08 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.902 1.281 . . . . 0.0 109.704 -174.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 3.7 p30 . . . . . 0 C--O 1.251 1.148 0 C-N-CA 125.098 1.359 . . . . 0.0 113.357 167.359 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.6 mtt . . . . . 0 N--CA 1.477 0.911 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -48.96 -45.59 42.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.0 1.72 . . . . 0.0 114.416 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -69.51 -36.5 76.52 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.548 0.739 . . . . 0.0 110.7 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -63.7 -37.22 86.53 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.425 -0.797 . . . . 0.0 112.835 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -72.21 -17.76 61.9 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.18 -28.32 16.35 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.3 -36.23 68.87 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 119.471 1.032 . . . . 0.0 112.512 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -60.1 -33.67 72.43 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 119.072 0.851 . . . . 0.0 111.344 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.62 -34.02 62.7 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.678 0.791 . . . . 0.0 113.041 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -64.74 -42.83 94.88 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 121.316 -0.865 . . . . 0.0 111.435 168.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -60.87 -41.83 99.39 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 121.669 -0.644 . . . . 0.0 112.482 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -58.74 -38.43 78.39 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.784 -0.833 . . . . 0.0 112.544 172.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.7 t -68.83 -42.46 77.17 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.683 0.674 . . . . 0.0 111.901 175.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -56.76 -40.45 75.85 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.868 1.213 . . . . 0.0 112.438 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.428 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 35.4 m-85 -58.14 -39.07 77.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 118.857 0.753 . . . . 0.0 112.322 171.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.56 65.29 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -84.86 4.46 33.13 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 119.226 0.921 . . . . 0.0 113.157 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.75 4.57 90.01 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-O 119.142 -0.81 . . . . 0.0 114.151 179.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 77.8 mt -84.62 54.04 2.89 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.313 1.557 . . . . 0.0 111.622 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -57.35 -32.25 66.56 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.897 1.279 . . . . 0.0 113.306 -173.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -83.59 -23.95 31.71 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.336 1.426 . . . . 0.0 113.039 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -75.76 -36.8 59.75 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.277 0.944 . . . . 0.0 111.21 164.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.428 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -75.76 -38.1 58.66 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.428 HG13 ' CE2' ' A' ' 27' ' ' TYR . 33.0 t -64.88 -35.56 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 O-C-N 120.626 -1.296 . . . . 0.0 110.885 170.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -59.88 -33.36 71.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.032 0.833 . . . . 0.0 112.267 171.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.6 m -64.64 -36.19 83.46 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.465 173.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.428 ' CE2' HG13 ' A' ' 24' ' ' VAL 0.336 0.2 OUTLIER -66.11 -29.82 70.2 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.491 1.496 . . . . 0.0 114.249 -178.826 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.59 -36.12 80.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.317 0.962 . . . . 0.0 112.096 172.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -61.62 -34.15 75.15 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 118.763 0.711 . . . . 0.0 112.659 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mt -65.41 -37.08 85.88 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 121.711 -0.618 . . . . 0.0 110.873 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.7 mt -82.18 -35.81 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 110.444 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.8 m -63.37 -31.66 72.88 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 120.4 1.454 . . . . 0.0 112.628 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.13 -29.37 57.79 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 169.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -134.65 61.81 50.59 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 124.838 1.255 . . . . 0.0 112.286 -169.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -64.04 -25.4 66.27 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 122.601 2.201 . . . . 0.0 117.279 -160.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -120.06 23.34 11.05 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.538 1.135 . . . . 0.0 111.728 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -106.44 123.29 39.28 Favored Pre-proline 0 CA--C 1.544 0.734 0 O-C-N 121.182 -0.949 . . . . 0.0 112.824 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.97 -13.64 24.03 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.116 2.544 . . . . 0.0 115.983 174.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.16 -37.77 57.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 120.262 1.392 . . . . 0.0 112.663 166.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -70.17 -44.49 60.04 Favored Glycine 0 CA--C 1.529 0.927 0 CA-C-N 118.647 0.658 . . . . 0.0 111.573 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -65.32 -37.73 88.0 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.874 -0.78 . . . . 0.0 111.628 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 37.3 m -59.99 -37.55 80.01 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.455 1.102 . . . . 0.0 111.884 171.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -81.47 -24.99 36.42 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -65.84 -40.82 92.1 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.971 -1.081 . . . . 0.0 111.614 163.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.25 -38.95 93.15 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 119.107 0.867 . . . . 0.0 112.596 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.1 tpt -60.41 -43.11 97.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.635 1.174 . . . . 0.0 112.043 170.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.21 -44.05 95.46 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.561 1.073 . . . . 0.0 112.417 172.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.5 mt -61.39 -44.57 96.92 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.536 0.734 . . . . 0.0 112.419 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -70.27 -29.0 37.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 119.432 1.014 . . . . 0.0 112.716 175.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 -10.76 59.74 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.23 -7.06 23.41 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.798 2.039 . . . . 0.0 112.55 167.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.21 14.21 75.01 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 124.7 1.143 . . . . 0.0 115.767 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -90.15 51.16 1.98 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.389 1.476 . . . . 0.0 110.769 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -55.35 -37.4 67.44 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.086 1.354 . . . . 0.0 112.467 -173.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.4 m -65.03 -22.84 67.05 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.993 1.317 . . . . 0.0 113.546 177.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -81.23 -39.5 25.26 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.215 0.916 . . . . 0.0 110.769 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -37.41 87.04 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.596 -0.69 . . . . 0.0 112.707 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.0 pt -63.07 -33.17 59.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 CA-C-N 119.09 0.859 . . . . 0.0 113.127 177.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -72.68 -47.9 43.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.626 0.648 . . . . 0.0 110.969 169.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 29.0 ttm -63.58 -31.88 73.18 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 82.9 m -69.18 -39.93 78.42 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.121 -0.987 . . . . 0.0 111.798 174.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -69.4 -36.26 76.58 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.449 -0.782 . . . . 0.0 111.256 174.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.75 -30.74 69.06 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.724 -1.235 . . . . 0.0 112.701 167.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.18 -31.69 54.38 Favored Glycine 0 N--CA 1.47 0.913 0 CA-C-N 120.612 1.551 . . . . 0.0 113.573 171.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.54 -28.92 70.27 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.34 1.57 . . . . 0.0 112.325 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -58.3 -16.04 12.65 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 169.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -88.65 2.8 52.55 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.223 1.409 . . . . 0.0 113.424 173.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -114.27 80.27 1.37 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -167.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.1 m -134.64 7.07 3.52 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.943 1.297 . . . . 0.0 114.151 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -143.02 161.13 38.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.389 1.475 . . . . 0.0 112.197 -173.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.0 -5.92 29.79 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -164.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -98.25 9.71 42.35 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 120.581 -1.324 . . . . 0.0 114.419 173.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -135.96 11.33 3.35 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 6.1 m -70.13 -35.57 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 120.183 -1.573 . . . . 0.0 114.236 -176.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.47 -29.39 46.8 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.975 -1.078 . . . . 0.0 111.457 171.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.5 mm -58.33 -35.03 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 O-C-N 121.515 -0.741 . . . . 0.0 111.447 165.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttt-85 -57.39 -46.74 83.12 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.441 1.019 . . . . 0.0 110.715 173.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 75.3 m -64.69 -37.31 87.13 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.407 1.083 . . . . 0.0 113.591 171.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -57.18 -48.99 77.37 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.275 0.943 . . . . 0.0 110.842 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.93 -25.59 56.11 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 117.303 -1.332 . . . . 0.0 113.775 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -58.06 -53.8 54.16 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 120.855 1.662 . . . . 0.0 110.41 166.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -30.03 60.78 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -174.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.7 mmt-85 -58.42 -37.42 75.33 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.812 1.187 . . . . 0.0 112.103 169.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.4 tp -71.92 -39.99 69.08 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.827 0.739 . . . . 0.0 112.098 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -58.02 -39.88 79.45 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.548 -0.72 . . . . 0.0 112.167 169.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.2 -19.46 33.98 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 120.965 -1.084 . . . . 0.0 113.771 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.42 -37.54 77.49 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.488 1.495 . . . . 0.0 111.373 164.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -69.11 -29.4 67.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.951 0.9 . . . . 0.0 111.826 169.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -55.3 13.84 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 126.374 1.94 . . . . 0.0 112.107 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.65 -27.72 65.28 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.123 1.369 . . . . 0.0 113.637 -174.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p -74.97 -24.52 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 CA-C-N 119.056 0.844 . . . . 0.0 112.61 172.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.83 -168.53 54.08 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.904 1.24 . . . . 0.0 115.917 170.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.9 t -148.6 173.0 13.63 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.601 1.56 . . . . 0.0 113.165 -174.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.8 t -67.82 -25.91 33.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.405 1.082 . . . . 0.0 111.351 161.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -79.07 172.44 13.8 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.339 1.056 . . . . 0.0 112.933 170.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 mt 54.3 77.02 0.46 Allowed Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 127.41 2.284 . . . . 0.0 110.718 -176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -82.22 -13.48 10.03 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.235 1.956 . . . . 0.0 112.55 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.5 t 55.3 56.2 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.348 1.859 . . . . 0.0 111.787 -170.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 95.2 t -131.09 125.83 58.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.771 1.629 . . . . 0.0 109.089 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 41.53 -122.6 0.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.313 1.845 . . . . 0.0 113.509 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 15.9 m -139.53 -27.87 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 125.495 1.518 . . . . 0.0 114.066 178.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 119.847 1.203 . . . . 0.0 114.234 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -92.47 8.62 37.92 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.996 -1.065 . . . . 0.0 113.206 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.0 mt -116.53 150.18 45.08 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 126.302 1.841 . . . . 0.0 111.724 -173.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -83.18 162.8 15.35 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 124.038 3.158 . . . . 0.0 113.62 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -69.04 145.36 53.58 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 122.223 1.011 . . . . 0.0 112.064 176.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.68 -38.27 3.16 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 125.175 1.369 . . . . 0.0 111.004 -157.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -92.82 -58.4 2.35 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 118.448 1.124 . . . . 0.0 111.589 173.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -152.25 147.44 26.38 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.129 0.972 . . . . 0.0 110.893 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 37.4 ttp180 -142.26 143.91 33.07 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.874 0.87 . . . . 0.0 111.439 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 C--O 1.252 1.223 0 C-N-CA 124.875 1.27 . . . . 0.0 114.163 -169.728 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.071 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -64.32 148.49 50.2 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.39 1.45 . . . . 0.0 114.368 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -126.54 164.94 20.08 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.906 1.683 . . . . 0.0 111.594 -179.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.6 -13.86 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 N-CA-C 117.605 2.446 . . . . 0.0 117.605 -166.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 N--CA 1.488 1.436 0 N-CA-C 118.687 2.847 . . . . 0.0 118.687 169.917 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ptm . . . . . 0 N--CA 1.476 0.871 0 CA-C-O 118.993 -0.527 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -57.67 -32.3 67.19 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -164.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -62.03 -44.31 96.98 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.493 1.497 . . . . 0.0 111.433 176.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -40.91 91.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.358 1.063 . . . . 0.0 111.358 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -61.2 -25.44 67.04 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.172 1.389 . . . . 0.0 113.161 171.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -77.7 -47.62 18.7 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.129 0.972 . . . . 0.0 111.49 178.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.66 -31.7 68.72 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 -176.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -58.58 -35.02 71.73 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 119.298 0.954 . . . . 0.0 112.991 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.56 -21.25 20.19 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.68 -42.12 98.5 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 110.561 171.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.84 -36.96 91.73 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-O 119.218 -0.768 . . . . 0.0 114.224 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -57.15 -46.34 82.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 118.857 1.329 . . . . 0.0 111.989 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -67.54 -43.42 80.77 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 124.153 0.981 . . . . 0.0 111.748 176.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.21 -42.95 87.32 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.443 -0.786 . . . . 0.0 111.736 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -59.07 -40.0 83.84 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.918 -1.114 . . . . 0.0 112.447 170.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -33.91 77.04 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.45 1.1 . . . . 0.0 113.659 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -79.48 -9.49 59.62 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 169.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.0 18.72 55.46 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.046 -1.033 . . . . 0.0 114.621 -175.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 mt -93.28 55.0 2.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 127.178 2.191 . . . . 0.0 110.002 -176.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 -61.5 -38.89 88.97 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -167.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.28 -38.47 65.89 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.145 0.884 . . . . 0.0 110.917 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -66.02 -34.86 79.04 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 122.974 0.509 . . . . 0.0 111.967 174.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.39 -53.15 53.04 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.952 0.501 . . . . 0.0 111.986 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.2 t -63.26 -32.34 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.665 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -53.82 -51.47 63.43 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.175 0.898 . . . . 0.0 111.416 170.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 99.7 m -57.89 -40.2 79.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.083 0.953 . . . . 0.0 112.204 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.415 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 76.8 m-85 -70.47 -41.25 73.0 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.717 0.689 . . . . 0.0 112.659 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -67.34 -25.52 66.04 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.896 0.771 . . . . 0.0 112.492 174.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -65.38 -32.0 73.4 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.342 -1.474 . . . . 0.0 111.767 169.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -68.03 -38.75 82.89 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 119.075 0.852 . . . . 0.0 110.919 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.9 mm -68.29 -37.23 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.697 0.799 . . . . 0.0 110.595 173.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.1 m -59.93 -32.49 70.83 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.951 1.3 . . . . 0.0 112.708 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -96.41 -16.85 20.99 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -138.36 51.56 3.91 Favored Pre-proline 0 CA--C 1.556 1.194 0 C-N-CA 123.958 0.903 . . . . 0.0 112.707 -166.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -61.62 -27.09 81.08 Favored 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 122.383 2.055 . . . . 0.0 116.803 -159.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -102.38 0.5 34.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -83.11 118.85 72.94 Favored Pre-proline 0 CA--C 1.544 0.735 0 O-C-N 121.028 -1.045 . . . . 0.0 112.361 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -54.34 -25.42 39.1 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.079 2.519 . . . . 0.0 114.852 174.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -52.48 -44.61 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.058 0.943 . . . . 0.0 112.376 176.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.81 -44.83 60.83 Favored Glycine 0 CA--C 1.528 0.876 0 O-C-N 121.56 -0.713 . . . . 0.0 112.359 -177.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -60.78 -33.73 73.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.465 0.706 . . . . 0.0 111.859 173.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.0 t -68.43 -41.63 80.07 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.264 -0.897 . . . . 0.0 113.092 172.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -64.87 -35.37 80.92 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 118.676 0.671 . . . . 0.0 111.294 173.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -73.37 -31.65 64.05 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.785 -1.197 . . . . 0.0 112.767 175.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.28 93.93 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 120.868 -1.145 . . . . 0.0 112.224 168.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 43.4 tpp -59.0 -40.5 85.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.051 0.941 . . . . 0.0 111.609 169.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.89 -45.68 91.74 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.516 -0.74 . . . . 0.0 112.776 174.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.9 mt -66.14 -36.35 82.89 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.531 -0.731 . . . . 0.0 112.691 -176.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 44.6 pt -71.61 -28.8 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 119.737 1.153 . . . . 0.0 112.966 171.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.34 -20.85 36.49 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 tt -81.16 -32.82 33.49 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.286 1.434 . . . . 0.0 110.528 164.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 103.45 21.0 10.22 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.26 1.41 . . . . 0.0 114.842 175.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -96.11 57.86 1.79 Allowed 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.875 1.338 . . . . 0.0 110.058 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -54.55 -37.86 65.93 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.854 1.262 . . . . 0.0 112.603 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.72 -23.28 67.2 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.245 1.018 . . . . 0.0 112.566 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -87.84 -31.72 19.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.826 0.85 . . . . 0.0 111.884 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -40.3 88.14 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.624 0.769 . . . . 0.0 112.162 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.454 HG22 HD12 ' A' ' 84' ' ' LEU . 34.1 pt -62.2 -38.96 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 118.828 0.74 . . . . 0.0 112.011 177.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.83 -44.69 92.45 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.688 0.795 . . . . 0.0 111.177 172.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.5 ttm -65.23 -31.35 72.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.784 0.72 . . . . 0.0 112.928 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.2 m -69.45 -42.82 74.41 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.994 -1.066 . . . . 0.0 111.817 174.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -62.11 -41.53 98.32 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.723 0.692 . . . . 0.0 111.947 172.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -34.95 77.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.453 1.101 . . . . 0.0 111.797 172.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.38 -30.33 56.91 Favored Glycine 0 CA--C 1.532 1.107 0 O-C-N 120.651 -1.28 . . . . 0.0 114.393 177.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.59 -30.02 68.38 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.58 1.69 . . . . 0.0 111.949 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 82.1 mtt-85 -63.85 -16.7 61.96 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 173.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -92.57 34.71 1.05 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.164 1.385 . . . . 0.0 113.045 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.9 p -144.21 137.78 27.6 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 120.511 -1.368 . . . . 0.0 114.055 -166.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.7 t -163.73 -50.34 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 163.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -85.47 175.73 8.66 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.714 0.806 . . . . 0.0 112.895 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.01 -10.62 51.73 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -170.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -80.07 -2.03 42.59 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.081 -1.012 . . . . 0.0 113.394 167.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -120.65 -9.46 9.36 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.285 1.434 . . . . 0.0 114.436 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.1 m -68.59 -31.21 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 O-C-N 119.845 -1.784 . . . . 0.0 113.535 -173.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.02 -37.67 64.29 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.19 0.904 . . . . 0.0 111.649 165.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -57.08 -32.91 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.376 -0.828 . . . . 0.0 112.979 175.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.3 mtm180 -61.79 -44.74 96.27 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.191 0.996 . . . . 0.0 112.006 174.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.3 t -65.66 -38.78 90.29 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 118.747 0.703 . . . . 0.0 111.485 169.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -73.0 7.26 2.15 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.42 1.488 . . . . 0.0 114.367 176.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -114.83 -33.25 5.53 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.527 1.058 . . . . 0.0 112.629 153.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -68.13 -41.29 81.9 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 120.455 1.48 . . . . 0.0 114.116 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -34.59 78.09 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.434 -1.417 . . . . 0.0 111.191 173.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -60.93 -37.02 80.86 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 121.488 -0.758 . . . . 0.0 111.122 174.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.454 HD12 HG22 ' A' ' 58' ' ' ILE . 38.3 tp -70.21 -40.87 74.31 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.067 1.347 . . . . 0.0 112.441 174.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.99 -31.31 72.45 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.39 -0.819 . . . . 0.0 112.609 171.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -88.35 -22.84 23.6 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.39 -40.25 95.86 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 120.596 1.544 . . . . 0.0 110.183 165.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -71.59 -31.91 67.45 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.477 1.111 . . . . 0.0 112.146 173.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.61 -47.18 63.47 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.26 1.409 . . . . 0.0 113.545 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -74.33 -26.29 60.06 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.261 1.424 . . . . 0.0 113.12 -176.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.4 p -76.33 -33.49 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.022 0.828 . . . . 0.0 112.481 173.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -173.92 145.71 8.33 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-N 119.139 0.881 . . . . 0.0 114.635 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -101.57 146.34 27.81 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.785 1.634 . . . . 0.0 111.624 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.7 m -113.37 24.94 4.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 125.302 1.441 . . . . 0.0 113.815 -169.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -62.51 168.46 3.61 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.51 1.124 . . . . 0.0 113.439 176.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp 60.17 92.58 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 126.426 1.89 . . . . 0.0 109.627 -171.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -81.06 -38.78 0.23 Allowed 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 122.446 2.097 . . . . 0.0 113.925 -175.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.2 t 51.22 40.86 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 CA-C-O 122.315 1.055 . . . . 0.0 112.094 -166.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 86.6 t -144.39 115.18 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 127.425 2.29 . . . . 0.0 108.125 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 33.22 -103.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 127.026 2.13 . . . . 0.0 113.843 178.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 35.5 m -136.22 38.97 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 127.175 2.19 . . . . 0.0 111.761 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -59.67 -36.81 77.19 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -170.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -149.01 -62.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.467 1.107 . . . . 0.0 110.898 167.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 50.8 mt 66.28 130.67 0.03 OUTLIER Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 128.993 2.917 . . . . 0.0 115.33 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.44 131.78 23.98 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.712 2.942 . . . . 0.0 114.254 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 45.75 38.26 4.1 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.885 2.074 . . . . 0.0 115.19 174.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 109.16 -100.28 1.35 Allowed Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.405 1.479 . . . . 0.0 112.133 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.7 t80 64.63 12.34 7.46 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 117.891 2.552 . . . . 0.0 117.891 158.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -72.42 145.56 47.57 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.875 -1.765 . . . . 0.0 114.347 178.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 49.93 33.23 6.36 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.77 2.028 . . . . 0.0 113.745 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.253 1.258 0 C-N-CA 127.294 2.237 . . . . 0.0 114.411 -175.675 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -134.11 140.71 46.77 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.679 0.792 . . . . 0.0 111.433 175.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -73.74 140.35 45.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.303 1.041 . . . . 0.0 111.653 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 8.4 p -145.95 62.04 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.363 1.465 . . . . 0.0 108.729 174.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 C--O 1.25 1.118 0 C-N-CA 125.545 1.538 . . . . 0.0 113.701 -167.736 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.1 mtm . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -63.25 -12.51 29.41 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 115.33 1.604 . . . . 0.0 115.33 -173.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -52.67 -30.82 33.92 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.56 1.544 . . . . 0.0 113.242 171.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -92.66 -0.12 57.34 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 175.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -97.12 -37.95 9.92 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 126.212 1.805 . . . . 0.0 111.582 172.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -39.5 93.8 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.898 0.772 . . . . 0.0 111.499 171.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.85 -24.09 62.46 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -172.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -76.45 -36.62 57.82 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 121.185 -0.947 . . . . 0.0 112.942 171.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -66.24 -36.07 82.07 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.556 0.743 . . . . 0.0 112.261 170.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -63.65 -50.46 69.2 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.236 1.414 . . . . 0.0 111.088 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -55.84 -40.18 80.05 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.606 -0.684 . . . . 0.0 113.731 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -67.49 -37.72 83.27 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 118.765 1.282 . . . . 0.0 111.983 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 47.9 t -65.06 -46.03 82.89 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.228 0.611 . . . . 0.0 112.113 171.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.9 mt -57.68 -38.9 75.94 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.257 1.023 . . . . 0.0 111.996 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 50' ' ' LYS . 1.9 m-85 -56.59 -41.36 76.85 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.797 -0.564 . . . . 0.0 112.39 170.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -19.43 64.99 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.534 1.134 . . . . 0.0 113.901 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -91.84 -5.59 53.13 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 119.587 1.085 . . . . 0.0 113.693 168.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 11.35 72.1 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 121.15 -0.969 . . . . 0.0 114.526 -175.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.5 mt -83.67 51.12 1.94 Allowed 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.779 1.631 . . . . 0.0 110.616 175.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -55.76 -36.0 66.84 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.943 1.697 . . . . 0.0 112.85 -173.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -86.94 -33.69 19.6 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.377 -0.827 . . . . 0.0 112.202 -173.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -62.64 -41.02 98.8 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 118.511 0.596 . . . . 0.0 111.431 164.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.39 80.67 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.46 -35.15 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.729 -0.607 . . . . 0.0 111.205 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -62.63 -39.01 92.48 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 119.403 1.001 . . . . 0.0 112.029 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.3 t -64.77 -44.85 88.7 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.876 0.871 . . . . 0.0 111.781 174.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -63.06 -38.4 91.03 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.654 -0.654 . . . . 0.0 112.079 175.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -63.11 -26.45 68.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.641 1.176 . . . . 0.0 112.368 171.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -72.45 -27.68 62.46 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.302 1.41 . . . . 0.0 112.969 172.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.42 -44.0 92.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.728 1.149 . . . . 0.0 110.473 170.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.0 mt -66.32 -44.28 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.916 1.286 . . . . 0.0 110.103 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -61.01 -30.14 70.12 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.24 1.016 . . . . 0.0 112.384 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.77 -28.28 30.46 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 173.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -140.71 65.69 25.54 Favored Pre-proline 0 CA--C 1.562 1.409 0 C-N-CA 126.382 1.873 . . . . 0.0 111.552 -168.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -68.35 -19.19 43.96 Favored 'Trans proline' 0 C--N 1.353 0.806 0 N-CA-C 118.179 2.338 . . . . 0.0 118.179 -161.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -102.73 -8.66 20.67 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.381 -0.824 . . . . 0.0 112.736 177.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -77.3 140.76 65.55 Favored Pre-proline 0 CA--C 1.537 0.455 0 O-C-N 121.21 -0.931 . . . . 0.0 112.352 -174.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.33 -9.01 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.541 2.161 . . . . 0.0 113.871 175.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 p -61.74 -46.16 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 120.948 -1.095 . . . . 0.0 112.233 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.13 -36.1 64.13 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 120.918 -1.114 . . . . 0.0 113.168 175.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -58.3 -39.68 79.96 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.707 1.254 . . . . 0.0 111.492 169.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.5 m -62.02 -29.98 70.65 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.716 0.806 . . . . 0.0 112.207 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -87.86 -29.45 20.9 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -63.16 -39.78 95.65 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 121.174 1.807 . . . . 0.0 111.205 165.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.24 -34.1 75.86 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.904 -1.123 . . . . 0.0 112.925 169.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 tpt -63.75 -40.18 96.1 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.604 0.762 . . . . 0.0 111.724 172.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.94 86.96 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.708 0.685 . . . . 0.0 111.869 171.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -56.56 -41.7 77.32 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 119.42 1.009 . . . . 0.0 112.294 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.7 pt -76.1 -21.05 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.408 ' HB3' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -95.42 -15.7 22.81 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.031 1.287 . . . . 0.0 114.108 178.334 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.95 -28.4 15.82 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.455 1.902 . . . . 0.0 111.294 169.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CZ ' ' A' ' 54' ' ' TYR . . . 104.0 27.12 6.39 Favored Glycine 0 CA--C 1.531 1.078 0 N-CA-C 115.755 1.062 . . . . 0.0 115.755 173.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.02 54.49 1.12 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 122.385 1.088 . . . . 0.0 109.927 170.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.415 ' CZ ' ' HA2' ' A' ' 52' ' ' GLY . 7.0 m-85 -58.94 -32.79 69.91 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.726 1.21 . . . . 0.0 113.408 -169.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 52.8 m -75.12 -22.0 58.51 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.458 -0.776 . . . . 0.0 112.099 176.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.5 mm-40 -74.47 -36.57 63.31 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.58 -1.325 . . . . 0.0 110.931 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.66 -41.96 91.89 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.649 -0.657 . . . . 0.0 112.537 -175.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 20.7 pt -61.63 -36.96 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.561 0.619 . . . . 0.0 111.998 176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -66.39 -50.33 63.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.297 1.039 . . . . 0.0 110.804 173.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 49.9 ttm -63.8 -32.3 73.77 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.1 -42.41 72.74 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 120.867 -1.145 . . . . 0.0 112.093 175.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -71.73 -33.53 68.8 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.112 0.869 . . . . 0.0 111.79 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -36.86 77.84 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.335 1.054 . . . . 0.0 112.418 164.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.26 -29.8 61.71 Favored Glycine 0 CA--C 1.53 0.974 0 O-C-N 120.266 -1.521 . . . . 0.0 113.902 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.51 -21.8 62.86 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 119.558 1.679 . . . . 0.0 112.626 172.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -66.11 -9.18 28.81 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 170.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -109.23 27.75 9.21 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.762 2.025 . . . . 0.0 111.985 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 32.1 p -135.18 -0.78 2.69 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 -166.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 69.5 m -79.44 40.51 0.44 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 120.831 -1.168 . . . . 0.0 113.014 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.0 t -150.9 145.57 25.72 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.9 -13.53 11.35 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.981 1.312 . . . . 0.0 114.169 171.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -70.07 -28.04 65.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.769 1.228 . . . . 0.0 112.416 168.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -134.84 21.4 3.54 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.988 1.715 . . . . 0.0 112.697 -169.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 p -61.63 -35.22 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 120.642 -1.286 . . . . 0.0 112.168 175.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.26 -31.0 68.19 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.21 -0.931 . . . . 0.0 111.784 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 36.0 mm -67.68 -31.81 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 O-C-N 121.154 -0.966 . . . . 0.0 111.018 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -57.2 -40.87 78.3 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.248 -0.908 . . . . 0.0 111.441 172.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.9 m -76.96 -35.45 57.22 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 125.351 1.46 . . . . 0.0 113.603 174.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -52.36 -63.46 1.13 Allowed 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.779 1.172 . . . . 0.0 110.74 168.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -70.52 -26.63 63.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.073 0.851 . . . . 0.0 112.737 -169.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.81 -35.31 64.87 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.04 1.291 . . . . 0.0 114.012 173.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 -37.6 65.48 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.965 1.257 . . . . 0.0 111.343 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 57.3 mmt-85 -56.1 -42.93 77.56 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 119.575 1.08 . . . . 0.0 111.406 170.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.7 tp -67.54 -40.68 85.02 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.801 1.24 . . . . 0.0 112.469 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -63.63 -37.08 85.97 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 122.95 0.5 . . . . 0.0 112.31 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.2 -20.78 31.76 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.64 -47.81 83.14 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.281 1.4 . . . . 0.0 110.669 169.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.541 ' HA ' HG12 ' A' ' 91' ' ' VAL . 4.6 pt20 -76.02 -26.96 57.15 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 173.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.06 -25.94 74.22 Favored Glycine 0 CA--C 1.533 1.194 0 O-C-N 120.82 -1.175 . . . . 0.0 114.78 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -87.46 -33.7 18.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.92 1.288 . . . . 0.0 112.873 174.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.541 HG12 ' HA ' ' A' ' 88' ' ' GLN . 1.7 p -89.85 -30.49 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -173.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.53 52.18 4.08 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 118.117 2.007 . . . . 0.0 118.117 -152.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 m -67.83 143.97 55.54 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.535 1.168 . . . . 0.0 111.129 164.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 12.7 m -87.13 149.96 3.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -164.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -149.65 174.61 12.37 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.289 1.435 . . . . 0.0 113.159 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.415 HG22 HG13 ' A' ' 98' ' ' VAL . 9.4 mt 65.19 88.54 0.11 Allowed Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 127.795 2.438 . . . . 0.0 112.36 178.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -77.3 -15.02 16.2 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.942 2.428 . . . . 0.0 113.486 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.415 HG13 HG22 ' A' ' 96' ' ' ILE 0.329 15.9 m 55.08 0.03 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 118.859 2.911 . . . . 0.0 118.859 -177.813 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.4 m -131.01 5.46 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 126.458 1.903 . . . . 0.0 114.296 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -130.57 -175.06 3.53 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.244 1.418 . . . . 0.0 111.197 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 64.8 t -139.74 -29.97 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.805 1.242 . . . . 0.0 113.227 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -75.05 -27.99 60.22 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 115.921 1.822 . . . . 0.0 115.921 -166.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -104.38 -99.22 0.31 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.709 1.141 . . . . 0.0 109.551 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.1 mp 62.21 167.66 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 126.262 1.825 . . . . 0.0 112.004 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -77.37 168.17 23.33 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 CA-C-N 120.226 1.116 . . . . 0.0 112.032 166.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -51.95 123.6 10.77 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.525 1.53 . . . . 0.0 112.229 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.4 12.89 70.21 Favored Glycine 0 CA--C 1.538 1.475 0 N-CA-C 117.065 1.586 . . . . 0.0 117.065 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -80.05 -36.27 35.93 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.118 1.459 . . . . 0.0 113.454 -175.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -61.7 154.37 25.6 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 41.4 mtm180 65.23 4.57 2.67 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.526 1.93 . . . . 0.0 115.647 -177.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 97.3 p . . . . . 0 C--O 1.251 1.177 0 C-N-CA 124.609 1.163 . . . . 0.0 113.65 170.947 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.4 mpt? . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 120.707 0.289 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -101.94 159.32 15.46 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.034 1.334 . . . . 0.0 112.044 168.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -95.33 112.62 24.3 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.488 1.515 . . . . 0.0 109.62 173.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 5.9 p -97.89 -6.03 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 115.127 1.529 . . . . 0.0 115.127 -160.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 125.891 1.676 . . . . 0.0 114.147 179.042 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.5 mtt . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 121.25 0.548 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.9 m -93.98 -25.65 17.16 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.768 1.227 . . . . 0.0 112.394 -170.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -61.96 -47.25 85.69 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.355 1.462 . . . . 0.0 112.029 -176.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -7.66 56.9 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -87.57 -47.85 8.38 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.938 1.295 . . . . 0.0 111.078 170.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -27.73 67.9 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.773 -1.204 . . . . 0.0 112.608 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -28.15 63.7 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.101 1.319 . . . . 0.0 114.042 175.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 ptpp? -76.02 -30.27 58.43 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.687 -1.258 . . . . 0.0 111.369 171.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -71.29 -30.54 66.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 169.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -60.24 -48.6 81.04 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.188 0.995 . . . . 0.0 109.743 163.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.2 -38.91 57.39 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.896 0.76 . . . . 0.0 113.738 175.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.425 ' ND2' ' H ' ' B' ' 0' ' ' ASP . 60.2 t30 -60.51 -47.86 84.32 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.432 1.116 . . . . 0.0 112.317 176.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.8 m -66.3 -36.22 82.4 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.355 0.662 . . . . 0.0 112.599 175.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -61.14 -44.69 96.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.258 -0.901 . . . . 0.0 111.055 175.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -58.89 -39.73 82.31 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.349 0.977 . . . . 0.0 112.656 169.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.25 -27.93 65.88 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -84.75 -19.74 32.18 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.454 1.501 . . . . 0.0 113.07 170.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.29 9.69 38.22 Favored Glycine 0 N--CA 1.477 1.398 0 C-N-CA 125.256 1.408 . . . . 0.0 114.353 178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.0 mt -87.41 55.74 3.65 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 127.734 2.414 . . . . 0.0 110.031 -176.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -57.77 -40.2 79.23 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.429 1.092 . . . . 0.0 112.566 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -67.98 -39.34 83.31 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.144 0.884 . . . . 0.0 110.836 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -70.34 -33.14 71.12 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.255 1.022 . . . . 0.0 113.36 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.26 77.14 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.133 0.879 . . . . 0.0 112.377 173.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.6 t -64.86 -34.84 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.446 1.099 . . . . 0.0 111.402 174.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 -58.17 -33.85 69.68 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.286 0.948 . . . . 0.0 112.654 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 70.3 m -69.09 -46.15 68.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.803 0.729 . . . . 0.0 111.524 178.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.38 -31.59 72.46 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.628 1.104 . . . . 0.0 112.067 174.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.51 -29.51 70.77 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.198 -0.939 . . . . 0.0 112.454 174.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -70.97 -30.45 66.72 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.396 0.998 . . . . 0.0 112.302 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.6 mt -61.88 -54.01 47.9 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.849 0.75 . . . . 0.0 110.008 171.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 58.1 mt -73.94 -28.77 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.128 0.971 . . . . 0.0 111.846 -171.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -71.06 -27.21 63.47 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 120.913 -1.117 . . . . 0.0 112.287 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.94 -25.75 27.64 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 168.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -143.77 78.09 14.49 Favored Pre-proline 0 CA--C 1.553 1.075 0 C-N-CA 125.729 1.611 . . . . 0.0 112.213 -166.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -67.1 -22.13 47.89 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.742 2.295 . . . . 0.0 115.575 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -133.98 -11.75 2.59 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -163.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -65.91 128.78 94.06 Favored Pre-proline 0 CA--C 1.547 0.857 0 O-C-N 120.604 -1.31 . . . . 0.0 108.644 164.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -60.62 -22.45 72.66 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.739 2.292 . . . . 0.0 114.063 -178.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.18 -31.64 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.782 1.633 . . . . 0.0 114.23 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.65 -35.03 62.62 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.153 -0.967 . . . . 0.0 112.214 175.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -79.01 -37.3 39.5 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.193 0.997 . . . . 0.0 112.279 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 18.0 p -64.47 -30.41 71.44 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 121.5 -0.75 . . . . 0.0 112.835 172.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -79.43 -40.21 30.52 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 172.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -57.52 -40.49 78.88 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.151 0.887 . . . . 0.0 111.818 171.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.32 80.19 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 172.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -45.85 78.91 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.437 0.695 . . . . 0.0 111.935 172.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.78 -42.74 84.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.368 0.667 . . . . 0.0 111.512 174.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.99 -43.59 98.63 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.316 176.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 33.2 pt -72.47 -27.23 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 120.771 1.623 . . . . 0.0 113.585 175.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.5 -17.53 56.11 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.916 0.887 . . . . 0.0 113.164 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.26 -17.43 26.0 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.806 2.042 . . . . 0.0 112.02 166.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.89 29.97 21.91 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 125.023 1.297 . . . . 0.0 115.044 178.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.65 52.57 0.83 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.977 2.511 . . . . 0.0 109.628 174.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -58.92 -36.93 75.55 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 120.942 -1.099 . . . . 0.0 112.434 -170.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 m -62.05 -22.67 65.94 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.106 0.962 . . . . 0.0 113.405 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -81.29 -36.34 29.94 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.962 -1.086 . . . . 0.0 111.714 171.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.15 -38.5 78.83 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.8 pt -66.94 -30.84 50.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.706 0.802 . . . . 0.0 113.012 178.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -66.0 -49.72 66.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.292 0.637 . . . . 0.0 110.791 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 25.5 ttm -65.99 -31.01 71.67 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.8 m -71.74 -34.98 69.99 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 121.048 -1.033 . . . . 0.0 112.533 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -70.5 -33.34 71.1 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.086 -1.009 . . . . 0.0 112.346 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.75 -27.35 66.71 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.494 0.718 . . . . 0.0 112.189 168.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -85.01 -23.65 48.16 Favored Glycine 0 CA--C 1.538 1.525 0 O-C-N 120.302 -1.499 . . . . 0.0 114.778 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.7 mt -54.84 -27.72 44.39 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.603 1.701 . . . . 0.0 112.511 166.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -64.33 -2.66 2.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 115.81 174.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -117.93 28.13 8.59 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.953 1.701 . . . . 0.0 112.121 -174.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.8 p -123.46 -9.77 7.98 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 116.579 2.066 . . . . 0.0 116.579 -161.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.5 p -76.28 32.7 0.12 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -175.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.8 t -147.42 144.78 28.9 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 127.856 2.462 . . . . 0.0 110.606 -176.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.66 -21.53 64.49 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -61.72 -22.86 65.72 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.49 1.116 . . . . 0.0 113.128 173.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -129.37 22.03 5.61 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.678 1.591 . . . . 0.0 113.045 -171.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.28 -27.3 38.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 O-C-N 120.568 -1.332 . . . . 0.0 112.704 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.13 -29.4 34.79 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.842 -1.161 . . . . 0.0 112.014 172.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.0 mm -65.68 -32.63 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 124.932 1.293 . . . . 0.0 110.945 170.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 ttp180 -63.15 -37.97 89.31 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.179 -0.95 . . . . 0.0 112.975 177.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.7 m -67.66 -46.01 73.62 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.667 0.787 . . . . 0.0 112.286 166.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.69 -56.12 13.4 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.597 1.159 . . . . 0.0 111.704 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.4 -31.12 68.21 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.598 1.09 . . . . 0.0 113.462 -176.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -71.1 -40.84 71.27 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.748 1.158 . . . . 0.0 112.433 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.28 67.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.38 0.991 . . . . 0.0 111.931 173.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 120.349 1.431 . . . . 0.0 112.217 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 24.5 tp -64.94 -37.86 89.06 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.776 0.83 . . . . 0.0 112.229 176.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.47 -46.89 58.68 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 15.8 tp -73.02 -19.52 61.18 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 120.619 -1.3 . . . . 0.0 112.596 -177.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.74 -37.36 87.35 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 120.27 1.395 . . . . 0.0 112.489 168.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . 0.328 0.9 OUTLIER -78.79 -9.75 59.55 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 169.725 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -82.74 -43.76 7.58 Favored Glycine 0 CA--C 1.54 1.646 0 C-N-CA 125.23 1.395 . . . . 0.0 114.106 166.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.36 -28.99 65.55 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.075 1.75 . . . . 0.0 113.253 -177.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.12 -26.75 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 172.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 170.93 147.74 5.73 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 124.592 1.091 . . . . 0.0 112.062 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.3 m -71.0 -11.76 61.15 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.1 t -127.32 130.75 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 125.936 1.694 . . . . 0.0 108.434 162.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.93 7.64 1.43 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.6 mt -70.39 121.36 83.12 Favored Pre-proline 0 CA--C 1.548 0.896 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 155.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -75.46 -11.72 20.65 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.257 3.305 . . . . 0.0 114.778 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 t 58.26 48.0 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-O 122.895 1.331 . . . . 0.0 111.106 -172.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 18.7 m -130.26 166.84 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.876 1.67 . . . . 0.0 110.352 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -63.67 -55.49 23.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.775 0.658 . . . . 0.0 112.775 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 30.9 m -145.89 -24.55 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.96 -34.73 78.64 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -157.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -140.46 38.3 1.87 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 120.102 1.319 . . . . 0.0 113.589 -172.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.6 mt -64.4 163.32 26.67 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.556 1.542 . . . . 0.0 113.391 -178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -66.27 157.86 57.87 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.764 2.309 . . . . 0.0 111.929 158.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -62.28 135.23 57.37 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.861 1.264 . . . . 0.0 113.321 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 73.74 1.75 59.32 Favored Glycine 0 CA--C 1.537 1.467 0 C-N-CA 125.855 1.693 . . . . 0.0 115.988 175.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -69.41 -49.05 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.027 1.331 . . . . 0.0 112.204 -176.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -157.3 169.87 23.77 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-O 122.184 0.992 . . . . 0.0 113.297 167.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 8.5 ptp85 -123.45 149.55 44.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.414 2.286 . . . . 0.0 110.982 176.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.483 1.185 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -169.648 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 76.8 mtp . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -72.27 158.23 36.24 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.511 1.05 . . . . 0.0 113.404 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -150.52 152.96 34.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.173 -0.955 . . . . 0.0 113.422 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 23.5 t -22.45 123.74 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 129.452 3.101 . . . . 0.0 113.69 164.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . 0.425 ' H ' ' ND2' ' A' ' 12' ' ' ASN . 38.7 t70 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.455 1.902 . . . . 0.0 111.273 170.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.881 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.0 p -58.54 -37.3 75.37 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.409 1.484 . . . . 0.0 114.677 -166.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -65.76 -34.98 79.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.111 0.965 . . . . 0.0 111.928 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -15.74 57.2 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 113.644 0.979 . . . . 0.0 113.644 175.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -77.01 -48.33 18.23 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.894 -1.128 . . . . 0.0 111.355 166.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.53 -35.6 81.02 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 120.547 -1.346 . . . . 0.0 112.527 177.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.41 -21.92 62.79 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -84.55 -38.04 20.48 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.782 1.174 . . . . 0.0 112.253 171.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.86 -32.34 73.82 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.733 0.813 . . . . 0.0 111.736 176.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -56.49 -42.55 78.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.576 1.15 . . . . 0.0 112.107 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.69 -43.09 96.53 Favored Glycine 0 CA--C 1.533 1.216 0 O-C-N 121.587 -0.696 . . . . 0.0 113.252 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -64.5 -37.77 88.68 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.604 -0.939 . . . . 0.0 112.049 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 42.3 t -66.76 -45.56 78.18 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.654 -0.654 . . . . 0.0 111.877 173.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.3 mt -58.33 -36.67 73.75 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.317 0.962 . . . . 0.0 112.575 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -57.8 -40.73 80.6 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 170.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -38.76 91.75 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.938 0.895 . . . . 0.0 112.78 175.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -77.16 4.24 10.84 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 173.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.16 4.38 90.24 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 121.069 -1.019 . . . . 0.0 114.274 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 94.7 mt -88.95 55.44 3.35 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.863 1.665 . . . . 0.0 110.674 -174.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -57.05 -39.68 75.33 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.958 0.903 . . . . 0.0 111.837 -175.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.94 -38.21 69.86 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.53 -0.731 . . . . 0.0 111.553 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.53 -40.3 95.36 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.252 1.021 . . . . 0.0 111.763 171.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.49 84.11 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.351 -0.843 . . . . 0.0 112.034 175.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -59.37 -35.9 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.743 1.217 . . . . 0.0 111.063 172.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -63.22 -45.55 91.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.438 1.095 . . . . 0.0 111.577 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.15 -43.94 93.65 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.54 1.136 . . . . 0.0 112.011 177.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 24.7 m-85 -65.86 -35.21 80.03 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.778 -0.576 . . . . 0.0 112.396 174.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -67.94 -25.69 65.59 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.536 -0.728 . . . . 0.0 112.613 173.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 37.9 mm-40 -66.26 -34.7 78.6 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.283 1.401 . . . . 0.0 111.813 171.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.12 -48.11 83.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 118.689 0.677 . . . . 0.0 110.609 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 49.8 mt -72.03 -41.41 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.503 1.121 . . . . 0.0 110.212 -177.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.6 m -57.62 -37.93 74.1 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.768 0.827 . . . . 0.0 111.626 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.42 -29.25 47.03 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -136.08 62.16 44.15 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.625 1.57 . . . . 0.0 112.374 -168.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -64.42 -23.85 64.66 Favored 'Trans proline' 0 C--N 1.352 0.725 0 N-CA-C 117.516 2.083 . . . . 0.0 117.516 -161.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -104.01 4.85 34.93 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.267 1.027 . . . . 0.0 113.097 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -84.74 116.25 64.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 120.941 -1.1 . . . . 0.0 110.842 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.457 ' HA ' ' CD2' ' A' ' 41' ' ' TYR . 71.6 Cg_endo -64.19 -13.06 35.7 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.498 2.132 . . . . 0.0 114.223 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.8 p -52.24 -42.49 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 124.353 1.061 . . . . 0.0 112.228 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.01 -39.83 62.97 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.683 -0.509 . . . . 0.0 112.272 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 38' ' ' PRO . 2.7 m-30 -59.62 -38.99 82.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 117.576 0.688 . . . . 0.0 110.46 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.4 p -63.89 -35.93 82.27 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -79.43 -29.85 42.05 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.55 -0.718 . . . . 0.0 112.528 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -69.76 -33.17 72.05 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.417 1.008 . . . . 0.0 112.084 168.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.49 91.29 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.714 -1.241 . . . . 0.0 112.36 167.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.6 ttt -60.98 -37.81 83.74 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.641 -0.662 . . . . 0.0 111.865 170.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.417 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.58 -46.59 88.48 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.885 0.766 . . . . 0.0 111.761 173.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.1 mt -63.18 -37.4 87.07 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.554 -0.716 . . . . 0.0 112.678 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 26.6 pt -76.36 -7.64 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 172.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.37 -18.24 14.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.62 1.568 . . . . 0.0 113.207 176.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 tt -86.25 -34.64 20.35 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.563 1.945 . . . . 0.0 110.484 166.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 106.28 20.11 9.43 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 124.809 1.195 . . . . 0.0 114.961 177.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -96.35 53.61 1.33 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 126.015 1.726 . . . . 0.0 109.828 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -57.05 -34.58 68.39 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.778 1.231 . . . . 0.0 113.273 -169.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 23.5 m -66.63 -23.79 66.21 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.654 1.182 . . . . 0.0 112.299 176.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 -85.63 -34.93 21.25 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.408 -0.807 . . . . 0.0 111.102 168.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.37 97.21 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.378 -0.826 . . . . 0.0 112.479 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.3 pt -59.78 -40.4 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.654 0.661 . . . . 0.0 111.799 175.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -64.73 -44.93 88.58 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.99 1.316 . . . . 0.0 111.238 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 48.2 ttm -68.24 -32.67 73.02 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.452 -0.78 . . . . 0.0 112.776 177.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 80.7 m -69.55 -42.62 74.34 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 120.802 -1.186 . . . . 0.0 111.853 174.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -60.72 -41.36 95.13 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.441 0.696 . . . . 0.0 111.357 172.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.95 -29.32 69.57 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 171.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.28 -28.25 45.29 Favored Glycine 0 N--CA 1.474 1.178 0 CA-C-N 120.768 1.622 . . . . 0.0 114.524 174.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.09 -20.76 65.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 119.887 1.844 . . . . 0.0 112.81 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 -57.44 -11.98 2.29 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.51 1.524 . . . . 0.0 114.687 165.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -116.09 32.22 6.24 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 126.998 2.119 . . . . 0.0 112.242 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 43.6 p -136.99 8.48 2.99 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -167.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 55.2 m -78.62 2.89 17.85 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.4 t -144.27 156.08 44.12 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.891 -1.131 . . . . 0.0 113.177 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.12 -28.0 16.2 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 127.171 2.188 . . . . 0.0 116.734 -166.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -75.45 -0.0 18.57 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -132.27 16.91 4.52 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.974 1.71 . . . . 0.0 113.545 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.58 -27.73 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 119.534 -1.979 . . . . 0.0 113.338 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.85 74.2 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.655 -0.653 . . . . 0.0 111.193 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.9 mm -68.29 -34.42 66.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.08 0.952 . . . . 0.0 111.033 174.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -52.51 -59.61 4.23 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 119.084 0.856 . . . . 0.0 109.901 171.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.7 m -61.64 -39.59 91.86 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.902 1.281 . . . . 0.0 113.115 176.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.8 ttpt -79.44 4.4 15.64 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -110.65 -29.29 8.08 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-O 117.177 -1.392 . . . . 0.0 113.287 152.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -53.86 -57.72 9.91 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 121.315 1.871 . . . . 0.0 111.203 172.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -31.92 73.01 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.786 -0.571 . . . . 0.0 111.457 -172.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -62.98 -43.57 98.42 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.823 0.849 . . . . 0.0 111.152 174.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.2 tp -66.92 -42.62 85.07 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.649 1.179 . . . . 0.0 111.194 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.3 -33.98 74.46 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.735 1.214 . . . . 0.0 113.095 174.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 18.8 mt -93.56 -12.29 29.87 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 114.603 1.334 . . . . 0.0 114.603 174.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -46.21 78.41 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.932 1.696 . . . . 0.0 110.298 164.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -74.09 -16.24 61.03 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 171.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -76.06 -47.73 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.034 1.778 . . . . 0.0 113.579 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.19 -31.58 66.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.869 1.667 . . . . 0.0 112.816 -176.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.77 -15.72 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -139.96 -131.63 2.8 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 125.742 1.639 . . . . 0.0 112.848 -169.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 19.1 m -107.09 136.26 47.25 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.344 1.058 . . . . 0.0 112.096 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 5.5 m -100.31 172.38 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 126.006 1.722 . . . . 0.0 112.53 175.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -73.77 -158.25 0.06 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.368 1.067 . . . . 0.0 112.031 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.1 mt 60.27 67.82 1.55 Allowed Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.926 1.69 . . . . 0.0 109.573 -170.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.67 -15.7 24.17 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 123.075 2.517 . . . . 0.0 113.317 -175.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.3 t 61.15 22.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 114.15 1.166 . . . . 0.0 114.15 -176.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.1 m -140.08 158.86 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.227 2.211 . . . . 0.0 108.972 170.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.03 147.73 46.26 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -176.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . 0.268 1.9 p 51.22 1.37 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 130.255 3.422 . . . . 0.0 119.064 171.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -86.11 53.76 2.9 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 119.529 -1.982 . . . . 0.0 115.846 -166.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . 0.258 21.2 tt0 68.42 50.84 0.69 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.207 1.803 . . . . 0.0 110.265 -174.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pp -87.02 156.42 54.93 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 126.483 1.913 . . . . 0.0 112.189 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.55 157.6 35.99 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 122.615 2.21 . . . . 0.0 114.299 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -56.77 -28.51 61.36 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.119 1.368 . . . . 0.0 114.06 -177.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -107.75 9.92 37.82 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.205 1.383 . . . . 0.0 115.744 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -88.56 -36.15 16.51 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 119.93 1.865 . . . . 0.0 114.85 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -128.92 -1.85 5.26 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -125.74 167.22 15.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.062 1.745 . . . . 0.0 111.177 170.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 78.3 p . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 126.774 2.03 . . . . 0.0 114.438 -176.888 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.46 -26.63 13.79 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 120.025 1.284 . . . . 0.0 112.201 167.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 63.91 171.07 0.17 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.588 2.355 . . . . 0.0 115.338 174.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 9.3 p -160.92 163.08 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 127.007 2.123 . . . . 0.0 108.993 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.253 1.26 0 C-N-CA 127.594 2.357 . . . . 0.0 116.01 -175.395 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -65.44 -20.25 66.29 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.049 -1.032 . . . . 0.0 113.541 -172.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -63.42 -42.47 98.73 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.42 1.488 . . . . 0.0 111.372 171.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.33 -15.13 61.88 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.638 -1.289 . . . . 0.0 113.788 176.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -80.86 -46.67 14.91 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.927 0.891 . . . . 0.0 110.666 165.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.56 -37.3 83.34 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.418 -1.426 . . . . 0.0 112.676 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -73.65 -24.26 59.98 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.918 0.887 . . . . 0.0 113.13 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -83.89 -31.81 25.5 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.15 0.886 . . . . 0.0 113.191 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.46 -45.38 69.19 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.928 0.785 . . . . 0.0 111.183 169.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -50.97 -48.15 61.21 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.841 1.256 . . . . 0.0 110.537 168.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.92 -24.54 50.32 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 117.805 -1.553 . . . . 0.0 114.792 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.418 HD22 ' HB ' ' B' ' -1' ' ' VAL . 37.3 t30 -90.23 -41.91 11.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 121.061 2.431 . . . . 0.0 111.575 173.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.4 t -57.43 -36.83 71.88 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.549 -0.719 . . . . 0.0 112.338 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.2 mt -62.54 -39.64 94.23 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.96 -1.088 . . . . 0.0 112.207 174.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -63.99 -40.3 96.06 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.876 1.216 . . . . 0.0 112.585 169.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.71 -42.5 83.91 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.348 0.522 . . . . 0.0 112.223 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -74.7 -36.37 62.72 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.267 1.427 . . . . 0.0 113.278 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 119.36 10.4 8.0 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.382 1.467 . . . . 0.0 115.577 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 79.7 mt -89.89 58.63 4.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.312 2.245 . . . . 0.0 109.64 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -60.07 -37.02 78.66 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.709 1.204 . . . . 0.0 113.595 -171.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.5 mmt-85 -73.65 -42.37 61.48 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.73 0.695 . . . . 0.0 110.624 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -65.15 -30.04 70.93 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.3 14.09 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.49 0.716 . . . . 0.0 111.308 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.81 -35.31 39.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.989 1.315 . . . . 0.0 111.907 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -54.62 -45.79 73.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.724 0.809 . . . . 0.0 112.397 170.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.4 m -63.99 -38.92 92.85 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.167 0.894 . . . . 0.0 112.21 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -67.42 -35.83 80.05 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 176.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -65.11 -29.05 69.88 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 118.689 0.677 . . . . 0.0 111.908 174.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 33.2 mm-40 -72.3 -26.36 61.94 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.509 1.049 . . . . 0.0 112.764 177.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.0 mt -62.69 -49.31 75.6 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.204 0.601 . . . . 0.0 110.593 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.3 mt -80.93 -27.6 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.694 1.198 . . . . 0.0 111.195 -173.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.4 m -62.25 -27.89 69.32 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.383 -1.448 . . . . 0.0 112.194 168.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -93.78 -27.29 16.56 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 171.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -135.83 76.11 54.03 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.067 1.747 . . . . 0.0 110.426 -171.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_exo -61.73 -25.0 78.27 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.938 3.092 . . . . 0.0 118.203 -166.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -116.46 -22.26 8.83 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.673 1.189 . . . . 0.0 112.502 -175.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.02 122.75 65.22 Favored Pre-proline 0 CA--C 1.545 0.777 0 O-C-N 121.657 -0.652 . . . . 0.0 112.57 -168.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.74 -20.4 51.13 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.112 2.541 . . . . 0.0 113.963 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.32 -32.65 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-N 119.114 0.87 . . . . 0.0 113.291 170.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.14 -40.89 15.05 Favored Glycine 0 C--N 1.34 0.778 0 O-C-N 121.409 -0.807 . . . . 0.0 111.846 174.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -70.93 -32.67 69.65 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -174.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.0 p -68.41 -41.12 80.88 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.722 1.601 . . . . 0.0 111.753 172.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -70.69 -36.44 73.3 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.832 0.853 . . . . 0.0 111.817 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -74.27 -29.5 61.69 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 120.565 -1.334 . . . . 0.0 112.115 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.04 -33.08 73.9 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 120.699 -1.251 . . . . 0.0 112.316 165.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -65.72 -40.58 92.37 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.333 -0.855 . . . . 0.0 111.189 171.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.1 -42.96 86.79 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.586 -0.696 . . . . 0.0 112.516 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.63 -40.47 87.71 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 118.197 -0.906 . . . . 0.0 112.488 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 31.4 pt -76.38 -25.51 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 CA-C-N 120.632 1.56 . . . . 0.0 113.452 175.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.17 -15.88 59.34 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 119.496 1.044 . . . . 0.0 113.268 172.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 tt -92.28 -34.05 14.39 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.791 1.636 . . . . 0.0 111.734 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 111.16 25.1 5.18 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 126.557 2.027 . . . . 0.0 115.982 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -99.0 56.6 1.05 Allowed 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 118.941 1.371 . . . . 0.0 111.938 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -57.44 -30.45 65.02 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.028 1.331 . . . . 0.0 113.663 -173.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 26.4 m -72.42 -30.73 64.88 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.178 0.899 . . . . 0.0 112.491 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -78.46 -30.72 47.55 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.144 0.884 . . . . 0.0 111.281 173.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.67 -40.84 92.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.98 0.912 . . . . 0.0 112.516 178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.9 pt -70.67 -25.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.6 tm0? -72.41 -44.15 62.88 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.677 0.672 . . . . 0.0 111.165 166.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.4 ttm -58.61 -31.83 68.45 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.78 0.718 . . . . 0.0 112.19 174.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 94.0 m -60.9 -46.89 88.84 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.512 -0.743 . . . . 0.0 112.572 171.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -68.87 -35.98 77.57 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.254 1.021 . . . . 0.0 112.209 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -27.22 69.01 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.764 0.826 . . . . 0.0 112.454 168.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.4 -27.15 52.85 Favored Glycine 0 CA--C 1.534 1.27 0 O-C-N 120.285 -1.51 . . . . 0.0 114.139 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.07 -12.49 55.79 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 119.096 1.448 . . . . 0.0 112.863 170.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -71.37 -5.55 33.47 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.22 1.408 . . . . 0.0 114.716 167.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.54 29.46 5.74 Favored 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.467 1.507 . . . . 0.0 113.659 -167.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 70.3 p -117.77 -5.14 11.11 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 116.943 2.201 . . . . 0.0 116.943 -161.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.89 30.57 0.5 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -155.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.8 p -144.32 163.85 32.52 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.009 1.324 . . . . 0.0 111.828 -176.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.15 -28.12 69.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.099 0.96 . . . . 0.0 113.192 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.16 -19.69 64.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.006 0.922 . . . . 0.0 112.809 172.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -127.66 12.51 6.87 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -171.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.3 p -64.62 -32.92 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 120.837 -1.164 . . . . 0.0 113.225 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.3 -37.32 52.94 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.273 -0.892 . . . . 0.0 110.645 170.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.17 -37.78 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.905 0.882 . . . . 0.0 112.681 171.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ttp85 -59.16 -40.99 87.31 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.91 0.884 . . . . 0.0 111.281 176.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.1 m -70.62 -39.44 73.72 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.966 0.906 . . . . 0.0 112.84 167.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -61.96 -29.65 70.39 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.202 1.365 . . . . 0.0 112.715 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -84.7 -38.28 19.93 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 119.717 1.144 . . . . 0.0 113.498 169.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -66.89 -40.75 87.86 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 120.362 1.437 . . . . 0.0 113.706 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.62 -36.81 73.67 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 118.498 0.59 . . . . 0.0 111.05 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -61.84 -36.14 80.32 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.881 0.872 . . . . 0.0 111.674 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.9 tt -67.4 -51.21 54.56 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.372 1.469 . . . . 0.0 110.6 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.07 -36.14 74.56 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.506 1.122 . . . . 0.0 112.562 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.48 -7.06 59.4 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 173.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.31 39.19 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 120.876 1.671 . . . . 0.0 109.179 164.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -63.51 -29.0 70.34 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.481 0.713 . . . . 0.0 111.388 169.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -70.41 -43.87 60.59 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 125.784 1.659 . . . . 0.0 113.707 172.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -76.11 -23.07 54.9 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.1 p -87.95 -15.4 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.431 0.692 . . . . 0.0 112.839 167.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -79.89 -162.74 26.04 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 125.821 1.677 . . . . 0.0 114.223 177.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 28.6 m -128.15 113.85 16.25 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.379 1.072 . . . . 0.0 112.837 -174.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.5 p -99.47 153.62 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 125.247 1.419 . . . . 0.0 110.715 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.72 110.5 21.55 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.352 1.461 . . . . 0.0 111.09 -178.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 48.4 mt -126.77 84.47 62.92 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 123.996 0.919 . . . . 0.0 109.317 -176.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -80.69 0.5 9.98 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.743 2.962 . . . . 0.0 114.762 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 59.05 27.27 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 115.378 1.621 . . . . 0.0 115.378 171.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 23.3 m -145.01 155.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 126.378 1.871 . . . . 0.0 109.453 177.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 50.34 -154.87 0.12 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.41 1.484 . . . . 0.0 114.659 -177.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.01 20.01 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 128.836 2.855 . . . . 0.0 111.621 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -112.34 -46.24 3.2 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.727 -1.233 . . . . 0.0 112.944 -157.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -120.25 16.67 12.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.405 1.882 . . . . 0.0 113.867 -173.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 76.4 mt -72.67 173.9 5.15 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 128.048 2.539 . . . . 0.0 111.793 160.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -63.59 -175.89 0.29 Allowed 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 122.73 2.286 . . . . 0.0 111.693 154.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.79 118.72 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.557 -1.34 . . . . 0.0 111.647 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.47 -111.06 3.85 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 125.155 1.359 . . . . 0.0 112.765 -173.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 18.7 t80 58.08 -27.8 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.773 2.829 . . . . 0.0 118.466 -176.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -43.05 110.45 0.19 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 121.911 2.141 . . . . 0.0 112.894 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -76.65 13.52 0.98 Allowed 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 126.554 1.942 . . . . 0.0 113.809 -169.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 74.3 m . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.93 2.092 . . . . 0.0 113.454 -171.583 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 19.8 ptm . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 120.445 0.165 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -150.19 162.54 40.26 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.607 1.163 . . . . 0.0 112.132 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -106.1 -102.5 0.34 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.59 1.156 . . . . 0.0 109.513 172.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . 0.418 ' HB ' HD22 ' A' ' 12' ' ' ASN . 14.6 m -136.67 166.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.794 1.638 . . . . 0.0 112.82 -169.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 29.9 t70 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 127.304 2.242 . . . . 0.0 115.221 -173.18 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.3 p -67.15 -31.6 72.15 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -163.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -67.23 -46.08 74.84 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.853 0.751 . . . . 0.0 112.063 177.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . 0.293 0.0 OUTLIER -71.22 -26.9 63.13 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.525 -1.36 . . . . 0.0 111.782 176.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -70.77 -13.73 62.16 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.04 -35.61 10.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.488 1.04 . . . . 0.0 112.878 166.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -70.77 -36.73 73.2 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.264 0.938 . . . . 0.0 113.116 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -63.66 -21.54 66.44 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.909 -1.12 . . . . 0.0 112.804 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -90.52 -34.74 15.43 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.089 1.356 . . . . 0.0 112.481 172.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -56.08 -41.15 74.71 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.845 1.258 . . . . 0.0 111.811 174.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.14 -42.3 71.83 Favored Glycine 0 CA--C 1.54 1.608 0 O-C-N 121.442 -0.786 . . . . 0.0 113.546 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -68.57 -40.22 80.66 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.952 1.376 . . . . 0.0 111.289 175.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.6 m -58.74 -36.55 74.49 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.425 -0.797 . . . . 0.0 112.714 172.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.35 -34.04 76.48 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 120.88 -1.138 . . . . 0.0 111.809 173.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -70.49 -26.64 63.7 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.21 -51.12 60.71 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 120.368 1.44 . . . . 0.0 110.343 166.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -66.55 -33.64 76.12 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.873 1.435 . . . . 0.0 114.873 -175.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 124.32 -0.4 8.83 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.956 1.142 . . . . 0.0 115.956 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 88.2 mt -89.54 53.16 2.52 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 127.233 2.213 . . . . 0.0 111.342 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -56.08 -36.89 68.63 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.892 1.677 . . . . 0.0 112.971 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -83.27 -28.52 29.08 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 121.03 -1.044 . . . . 0.0 112.982 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -73.43 -29.0 62.28 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 118.722 0.692 . . . . 0.0 112.118 166.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.21 69.05 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 172.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 72.6 t -60.24 -37.19 72.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 O-C-N 121.15 -0.969 . . . . 0.0 111.065 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -62.57 -45.75 91.48 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.66 -0.686 . . . . 0.0 112.237 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.5 t -55.19 -47.92 74.56 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.366 1.067 . . . . 0.0 111.481 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -68.67 -29.95 68.53 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -68.72 -23.47 64.36 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.224 -0.923 . . . . 0.0 112.78 168.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -69.63 -34.84 74.62 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.755 1.161 . . . . 0.0 111.242 172.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.47 -48.55 77.21 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 118.901 0.773 . . . . 0.0 109.915 174.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 36.8 mt -63.14 -37.95 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.952 0.501 . . . . 0.0 110.789 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.6 m -58.46 -39.5 80.09 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 121.47 -0.769 . . . . 0.0 112.027 174.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.25 -31.0 43.4 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.43 74.49 20.05 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 124.572 1.149 . . . . 0.0 112.859 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -63.35 -28.56 71.92 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.641 2.894 . . . . 0.0 117.436 -168.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -105.62 4.84 30.67 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.027 1.331 . . . . 0.0 112.957 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -85.51 120.55 73.18 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.342 -0.849 . . . . 0.0 110.103 178.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -61.93 -14.59 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 122.318 2.012 . . . . 0.0 114.226 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.4 p -47.14 -50.56 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.155 0.982 . . . . 0.0 111.416 167.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.11 -43.45 93.25 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 123.924 0.773 . . . . 0.0 112.5 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -63.53 -40.83 98.05 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.356 0.662 . . . . 0.0 112.169 173.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.0 p -67.43 -35.29 78.95 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.34 -0.85 . . . . 0.0 112.761 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -72.25 -38.51 68.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.144 0.978 . . . . 0.0 112.352 173.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -71.18 -32.26 68.65 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 119.411 1.005 . . . . 0.0 112.479 176.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.38 -42.09 96.35 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.114 -0.991 . . . . 0.0 112.322 168.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.0 -42.59 94.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.845 0.858 . . . . 0.0 111.511 171.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.86 -45.97 90.78 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.706 0.802 . . . . 0.0 112.414 175.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 48.9 mt -64.51 -34.92 79.35 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.61 -0.681 . . . . 0.0 112.812 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 41.8 pt -73.62 -35.78 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 119.73 1.15 . . . . 0.0 112.892 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.15 -12.83 61.36 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.44 1.096 . . . . 0.0 113.159 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.8 tt -93.44 -41.19 9.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.566 1.947 . . . . 0.0 111.528 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 110.63 21.85 6.63 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 124.772 1.177 . . . . 0.0 115.064 -178.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -100.87 51.48 0.86 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.564 1.546 . . . . 0.0 109.67 171.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -51.02 -41.7 59.98 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.6 1.96 . . . . 0.0 112.624 -176.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.1 m -63.72 -25.95 68.43 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 113.158 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.3 mm-40 -81.19 -35.9 30.8 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.179 -0.951 . . . . 0.0 111.233 171.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -39.41 91.77 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.803 0.841 . . . . 0.0 112.195 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.3 pt -64.32 -34.76 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.762 0.71 . . . . 0.0 112.474 177.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.5 tm0? -64.47 -47.91 77.22 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.811 0.732 . . . . 0.0 110.551 171.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.5 ttm -63.18 -31.34 72.46 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 178.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.8 m -66.83 -46.18 75.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.971 -1.08 . . . . 0.0 112.362 173.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -72.41 -32.7 66.57 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.622 0.769 . . . . 0.0 111.867 -178.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -39.0 92.87 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.953 1.301 . . . . 0.0 112.382 164.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.18 -28.19 73.02 Favored Glycine 0 N--CA 1.471 1.026 0 O-C-N 120.196 -1.565 . . . . 0.0 113.969 177.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.71 -23.1 67.23 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.454 1.127 . . . . 0.0 112.857 168.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -74.2 -0.18 15.99 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 169.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.22 20.71 15.98 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.597 1.559 . . . . 0.0 113.103 175.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.0 t -139.11 126.72 21.84 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.355 -1.466 . . . . 0.0 114.036 178.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -148.67 -36.02 0.19 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.073 1.749 . . . . 0.0 112.429 167.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 65.9 p -76.65 167.37 21.96 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.317 1.447 . . . . 0.0 113.622 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.86 -21.03 66.03 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.9 -1.125 . . . . 0.0 113.148 174.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -59.37 -28.45 66.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.401 1.08 . . . . 0.0 112.756 170.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -120.87 15.72 11.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.228 1.411 . . . . 0.0 112.369 -169.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.79 -37.24 61.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 121.247 -0.908 . . . . 0.0 112.259 -178.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.51 -36.41 63.2 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.688 -0.633 . . . . 0.0 110.623 172.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.8 mm -53.08 -39.98 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.397 1.079 . . . . 0.0 112.447 168.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -34.3 76.48 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.246 1.019 . . . . 0.0 112.257 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.9 m -80.21 -33.33 38.21 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.112 0.965 . . . . 0.0 113.489 166.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 ttpt -71.94 -3.07 20.51 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.341 1.456 . . . . 0.0 114.382 176.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -96.84 -47.64 5.77 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.182 0.901 . . . . 0.0 112.205 153.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.13 -32.09 69.93 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -171.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.43 -37.99 74.49 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 120.177 1.353 . . . . 0.0 111.019 173.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.358 4.5 ptp180 -80.41 -12.86 59.52 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.84 -44.14 67.06 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.452 1.101 . . . . 0.0 111.168 157.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -35.98 78.19 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.981 1.312 . . . . 0.0 112.815 171.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.93 -23.83 28.66 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.89 1.276 . . . . 0.0 113.826 176.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.7 75.52 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.349 1.431 . . . . 0.0 109.715 168.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -59.45 -26.31 65.11 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.733 1.213 . . . . 0.0 112.01 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.38 -58.7 7.55 Favored Glycine 0 N--CA 1.467 0.732 0 C-N-CA 127.351 2.405 . . . . 0.0 113.622 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.71 -31.73 68.69 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.1 0.96 . . . . 0.0 112.471 -174.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 2.2 p -83.8 -16.13 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -113.6 178.16 18.32 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 116.253 1.261 . . . . 0.0 116.253 -167.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.4 m -103.55 -30.6 10.4 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.826 2.05 . . . . 0.0 112.679 172.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.4 m -153.97 149.82 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 126.507 1.923 . . . . 0.0 112.576 174.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 6.8 mm-40 -90.49 143.6 26.6 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.433 1.093 . . . . 0.0 109.898 156.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.0 mt 57.78 79.22 0.33 Allowed Pre-proline 0 N--CA 1.478 0.97 0 C-N-CA 125.153 1.381 . . . . 0.0 110.526 -174.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -75.34 -6.02 17.33 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.294 1.996 . . . . 0.0 114.734 -174.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 18.6 t 51.84 80.58 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 126.497 1.919 . . . . 0.0 112.366 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 28.4 m -135.64 28.29 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.16 1.384 . . . . 0.0 112.937 -170.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . 0.292 7.8 mm-40 60.32 -92.84 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.851 1.66 . . . . 0.0 110.851 -158.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 94.2 t -140.36 123.27 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 125.189 1.396 . . . . 0.0 110.041 175.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -166.43 -61.47 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.021 1.328 . . . . 0.0 112.992 174.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -143.8 61.64 1.37 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.916 1.286 . . . . 0.0 112.004 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 mt -103.7 149.58 37.26 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.991 1.717 . . . . 0.0 110.861 175.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.24 125.95 14.29 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.511 2.141 . . . . 0.0 113.029 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 48.3 28.5 1.63 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.545 2.338 . . . . 0.0 114.961 -175.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.07 36.79 20.59 Favored Glycine 0 CA--C 1.534 1.259 0 O-C-N 120.91 -1.119 . . . . 0.0 114.77 178.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -64.4 152.25 41.95 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.006 1.322 . . . . 0.0 113.136 172.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.27 177.81 0.05 OUTLIER 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 127.547 2.339 . . . . 0.0 116.381 -175.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.31 172.22 13.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 126.991 2.117 . . . . 0.0 113.017 -171.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 88.7 p . . . . . 0 C--O 1.257 1.462 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -179.557 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 11.4 ttt . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 118.65 -0.691 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -146.28 -4.68 0.6 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 175.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 58.6 48.88 11.16 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.305 1.442 . . . . 0.0 114.563 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 8.7 p -96.89 146.46 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 125.408 1.483 . . . . 0.0 112.301 178.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 37.5 t70 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.189 1.396 . . . . 0.0 114.628 -178.821 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.3 tpp . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 121.302 0.572 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.0 m -56.74 -33.09 66.2 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -170.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -72.32 -29.1 63.52 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 120.782 1.628 . . . . 0.0 112.844 177.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -24.42 60.98 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.805 -1.185 . . . . 0.0 113.118 169.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.98 -24.31 30.66 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.998 0.919 . . . . 0.0 111.841 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.2 tttt -70.05 -51.2 33.9 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.081 1.752 . . . . 0.0 111.674 162.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -25.19 66.07 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -166.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.72 -40.0 63.89 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 172.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -71.19 -30.3 66.23 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.394 0.678 . . . . 0.0 111.655 175.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -68.1 -43.58 78.14 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.494 1.518 . . . . 0.0 111.05 170.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.36 -53.42 43.28 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.269 0.938 . . . . 0.0 112.679 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -56.37 -48.8 76.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.714 1.257 . . . . 0.0 111.659 174.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.7 t -55.92 -47.45 77.49 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.768 0.827 . . . . 0.0 113.153 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.4 mt -61.28 -28.56 69.27 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 121.278 -0.889 . . . . 0.0 112.815 -177.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -67.93 -37.49 81.71 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.282 0.946 . . . . 0.0 113.21 170.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.83 -36.41 81.1 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 119.906 1.23 . . . . 0.0 112.648 172.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -74.5 -6.18 46.94 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 171.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 75.83 11.5 84.56 Favored Glycine 0 CA--C 1.537 1.462 0 O-C-N 120.37 -1.456 . . . . 0.0 114.992 -178.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 48.5 mt -87.32 54.33 3.11 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.844 2.058 . . . . 0.0 110.613 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.9 m-30 -55.88 -36.19 67.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.359 1.063 . . . . 0.0 112.638 -170.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -80.56 -18.47 48.25 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.775 1.23 . . . . 0.0 113.01 -176.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.01 -36.41 17.04 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.063 0.545 . . . . 0.0 111.442 165.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.751 1.22 . . . . 0.0 112.733 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.51 -36.72 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 123.794 0.838 . . . . 0.0 110.389 172.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -64.85 -43.14 93.99 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.441 1.018 . . . . 0.0 112.872 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 56.0 m -61.67 -39.39 91.24 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 118.821 0.737 . . . . 0.0 112.263 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.464 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 32.8 m-85 -75.31 -35.53 61.23 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 175.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -62.38 -36.02 81.0 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.336 0.971 . . . . 0.0 111.414 171.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -74.71 -15.9 60.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.264 0.938 . . . . 0.0 113.271 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.9 mt -58.65 -47.37 84.68 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.304 0.956 . . . . 0.0 110.682 160.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.1 mt -81.79 -25.94 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.337 1.055 . . . . 0.0 112.053 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 m -62.9 -33.15 74.71 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.572 -1.33 . . . . 0.0 111.183 169.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.83 -37.07 18.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.607 1.163 . . . . 0.0 113.404 174.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -129.86 74.14 80.87 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 125.86 1.664 . . . . 0.0 110.603 -169.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -63.13 -19.44 68.8 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.723 2.949 . . . . 0.0 117.537 -167.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -124.3 -10.73 7.5 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.443 1.097 . . . . 0.0 113.107 -171.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -70.13 122.87 87.56 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 124.014 0.926 . . . . 0.0 111.258 -176.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HB2' HG21 ' A' ' 76' ' ' ILE . 85.4 Cg_endo -67.95 -9.23 24.99 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 121.999 1.8 . . . . 0.0 113.999 179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -46.38 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 119.605 1.093 . . . . 0.0 110.989 163.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -65.52 -39.88 95.84 Favored Glycine 0 CA--C 1.527 0.802 0 O-C-N 121.266 -0.896 . . . . 0.0 112.03 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -65.36 -38.86 91.35 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 117.77 0.785 . . . . 0.0 112.128 172.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 41.9 m -62.44 -38.28 89.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.211 1.005 . . . . 0.0 112.041 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -75.14 -40.78 59.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.534 1.133 . . . . 0.0 112.224 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -65.12 -31.79 73.16 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 120.292 -1.505 . . . . 0.0 112.244 173.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.31 -36.53 83.98 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.259 -0.9 . . . . 0.0 112.561 169.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.4 tpp -63.58 -44.11 95.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.099 0.863 . . . . 0.0 111.276 171.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.464 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -57.09 -48.29 78.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.264 0.626 . . . . 0.0 112.08 175.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.3 mt -64.59 -39.2 93.3 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.537 -0.727 . . . . 0.0 112.445 -177.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.52 -7.69 10.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 CA-C-N 120.07 1.305 . . . . 0.0 114.134 173.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.36 -20.1 14.72 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.053 1.341 . . . . 0.0 113.555 176.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -89.24 -9.7 49.73 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.411 2.284 . . . . 0.0 111.422 166.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.67 21.48 63.85 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.915 1.245 . . . . 0.0 114.866 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -92.59 51.2 1.7 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.561 1.944 . . . . 0.0 109.402 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -58.15 -37.17 74.14 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.081 -1.012 . . . . 0.0 112.445 -170.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 50.7 m -52.7 -31.81 39.48 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.899 1.28 . . . . 0.0 113.484 171.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -95.84 -27.09 15.37 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.353 1.461 . . . . 0.0 110.858 -177.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.21 -41.98 80.52 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.933 0.893 . . . . 0.0 112.078 170.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.5 pt -65.43 -35.01 74.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 118.999 0.818 . . . . 0.0 111.588 177.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -63.26 -45.54 91.05 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.013 0.925 . . . . 0.0 111.337 170.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 35.2 tpp -60.46 -43.76 96.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 118.955 0.798 . . . . 0.0 112.299 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -63.91 -46.61 84.04 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.128 -0.982 . . . . 0.0 112.246 177.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -62.75 -36.47 83.16 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.857 0.863 . . . . 0.0 112.181 174.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.4 -38.48 84.73 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.176 0.99 . . . . 0.0 111.788 172.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -70.94 -34.17 65.44 Favored Glycine 0 CA--C 1.53 0.998 0 O-C-N 120.269 -1.519 . . . . 0.0 113.598 178.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.78 -6.53 27.23 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 118.524 1.162 . . . . 0.0 113.401 175.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -76.48 -22.56 54.38 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 162.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -92.55 -7.31 47.57 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.862 1.265 . . . . 0.0 114.31 -176.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.0 p -86.54 -1.13 57.37 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.066 2.247 . . . . 0.0 117.066 -160.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 m -86.71 42.2 1.0 Allowed 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 120.206 1.366 . . . . 0.0 114.236 -169.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 p -138.62 159.65 41.57 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.198 1.399 . . . . 0.0 111.544 169.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.76 -6.97 17.99 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 178.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -87.18 -14.98 39.65 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.678 1.591 . . . . 0.0 112.259 171.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -126.36 14.51 7.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.455 1.502 . . . . 0.0 114.014 -173.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.19 -14.93 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 120.549 -1.344 . . . . 0.0 114.219 178.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.95 -39.19 15.95 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.914 -1.116 . . . . 0.0 111.267 164.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.409 HG21 ' HB2' ' A' ' 38' ' ' PRO . 47.6 mm -53.06 -36.48 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.132 0.973 . . . . 0.0 111.371 170.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.3 ttp180 -55.36 -39.5 70.14 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.831 1.252 . . . . 0.0 113.269 175.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.2 m -78.06 -37.9 45.65 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 125.036 1.335 . . . . 0.0 112.856 170.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.6 mttm -55.37 -51.72 65.88 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.943 1.247 . . . . 0.0 111.381 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.92 -31.19 64.47 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 120.092 1.315 . . . . 0.0 113.456 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -77.34 -30.72 54.09 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 120.971 1.714 . . . . 0.0 114.568 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -42.2 59.64 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.29 1.405 . . . . 0.0 110.655 166.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -62.16 -32.57 73.21 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 119.172 0.896 . . . . 0.0 111.688 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 17.5 tp -67.76 -44.28 77.87 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.756 1.222 . . . . 0.0 112.815 171.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -68.96 -32.46 72.06 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.282 -0.886 . . . . 0.0 113.352 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.6 tp -83.2 -22.12 33.28 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.46 -0.781 . . . . 0.0 112.678 174.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.34 -45.92 92.39 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.522 1.51 . . . . 0.0 111.089 164.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -63.58 -30.04 71.21 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.033 0.933 . . . . 0.0 111.989 172.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.32 -49.57 44.68 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 125.697 1.617 . . . . 0.0 112.538 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.63 -37.55 70.86 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.738 1.215 . . . . 0.0 112.162 -177.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.2 p -70.08 -34.3 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 O-C-N 121.42 -0.8 . . . . 0.0 111.655 174.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -89.41 8.68 79.31 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.215 1.864 . . . . 0.0 115.64 177.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.0 m -77.68 171.24 15.24 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.593 1.157 . . . . 0.0 111.547 173.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.25 18.1 m 53.37 16.55 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 128.191 2.596 . . . . 0.0 117.988 167.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 56.29 178.63 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.9 mt 64.0 77.59 0.3 Allowed Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 111.459 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -85.03 -5.37 9.62 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.574 2.85 . . . . 0.0 113.614 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 t 55.13 68.8 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.12 2.168 . . . . 0.0 113.062 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 34.5 m -122.48 35.0 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 127.318 2.247 . . . . 0.0 112.045 -177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 58.8 -59.65 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.372 3.069 . . . . 0.0 115.376 -166.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 27.7 m -143.02 -20.28 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -167.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -95.05 -18.6 20.88 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 116.472 2.027 . . . . 0.0 116.472 -154.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -144.17 115.52 8.03 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 126.231 1.812 . . . . 0.0 108.071 172.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.9 mt -159.25 155.28 23.51 Favored Pre-proline 0 CA--C 1.546 0.791 0 C-N-CA 124.912 1.285 . . . . 0.0 111.558 -173.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -67.05 157.77 60.11 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.024 1.816 . . . . 0.0 111.533 163.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.86 140.3 56.54 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -172.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 79.22 -1.93 73.25 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.057 1.313 . . . . 0.0 115.888 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -71.77 -51.19 23.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.362 1.581 . . . . 0.0 112.616 -176.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -156.13 -54.96 0.09 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.729 1.212 . . . . 0.0 111.997 172.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -156.62 -179.11 7.87 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 126.395 1.878 . . . . 0.0 111.753 -172.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.617 1.967 . . . . 0.0 112.411 -166.422 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 47.9 mtt . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -126.64 -64.73 1.0 Allowed 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.438 1.017 . . . . 0.0 111.83 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 46.93 88.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.162 2.185 . . . . 0.0 112.999 -172.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . 0.3 9.9 p -80.74 52.94 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 124.866 1.266 . . . . 0.0 113.963 -169.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . 0.265 35.4 m-20 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 129.688 3.195 . . . . 0.0 116.628 168.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.3 mmt . . . . . 0 N--CA 1.477 0.907 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 m -72.67 -29.29 63.29 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -155.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.76 -25.19 62.8 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.492 -1.38 . . . . 0.0 113.144 -176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -35.07 78.6 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.546 1.138 . . . . 0.0 112.332 170.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.525 ' HB2' ' HA ' ' B' ' -4' ' ' MET 0.257 0.2 OUTLIER -90.35 -14.43 33.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.92 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -27.97 32.94 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.667 1.187 . . . . 0.0 112.495 164.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -62.83 -50.68 70.02 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.958 1.303 . . . . 0.0 113.072 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -59.54 -30.48 68.63 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.07 -49.59 49.5 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.727 -0.608 . . . . 0.0 110.912 171.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -58.72 -37.11 75.44 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.764 0.826 . . . . 0.0 111.56 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.89 -15.01 54.77 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.885 1.231 . . . . 0.0 115.176 174.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -94.84 -45.82 7.14 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.63 1.715 . . . . 0.0 110.754 168.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.3 m -53.41 -44.61 68.86 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.62 0.768 . . . . 0.0 112.755 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 mt -58.91 -38.11 78.18 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.246 1.018 . . . . 0.0 112.825 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -61.5 -38.16 86.3 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.283 -0.886 . . . . 0.0 112.05 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -71.17 -10.32 59.56 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -102.48 -0.79 31.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.018 1.327 . . . . 0.0 113.868 165.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.22 5.34 82.95 Favored Glycine 0 CA--C 1.536 1.365 0 O-C-N 121.116 -0.99 . . . . 0.0 115.001 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 98.3 mt -83.73 52.74 2.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.746 1.618 . . . . 0.0 110.952 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -56.87 -40.43 76.17 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.926 1.29 . . . . 0.0 111.924 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -72.96 -39.25 66.34 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 118.728 -0.653 . . . . 0.0 111.608 -178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -70.26 -32.65 70.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.445 1.02 . . . . 0.0 111.373 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.95 -44.3 89.87 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.015 -1.053 . . . . 0.0 112.183 173.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.97 -42.16 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.656 0.783 . . . . 0.0 110.924 171.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 65.2 t60 -58.53 -45.55 88.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.05 0.841 . . . . 0.0 112.516 174.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.2 m -62.72 -41.84 99.36 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.538 1.135 . . . . 0.0 112.5 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -67.48 -36.35 80.95 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.462 -0.774 . . . . 0.0 112.244 172.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -64.37 -28.52 69.75 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.722 0.692 . . . . 0.0 112.576 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -68.99 -28.81 66.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.89 -1.131 . . . . 0.0 112.229 176.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.2 mt -63.5 -48.09 79.02 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.772 0.715 . . . . 0.0 110.373 169.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 26.6 mt -72.11 -24.72 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 C-N-CA 124.845 1.258 . . . . 0.0 111.241 -178.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 94.5 m -68.32 -31.28 70.58 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.754 1.222 . . . . 0.0 111.455 172.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -85.41 -32.84 22.14 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 118.985 0.811 . . . . 0.0 112.803 169.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -132.21 77.71 70.29 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.18 1.392 . . . . 0.0 112.672 -169.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -65.98 -18.32 56.91 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 121.87 1.713 . . . . 0.0 115.088 175.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -113.3 -26.72 8.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.042 1.337 . . . . 0.0 112.896 -170.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -70.46 127.44 92.06 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.193 1.361 . . . . 0.0 111.486 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -67.9 -7.63 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.725 2.284 . . . . 0.0 115.277 -176.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 p -55.48 -39.61 54.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.808 1.243 . . . . 0.0 111.687 171.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.9 -45.56 32.85 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.365 -0.834 . . . . 0.0 112.115 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -64.75 -40.38 95.21 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.744 -0.857 . . . . 0.0 112.388 177.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 72.1 p -69.89 -18.52 63.41 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -83.9 -40.42 18.61 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 112.078 168.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -57.51 -37.69 73.4 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.64 -1.287 . . . . 0.0 112.018 169.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.98 -29.6 70.94 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 171.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.1 tpt -66.45 -42.68 87.28 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.042 0.837 . . . . 0.0 111.059 173.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.8 -46.42 87.63 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.966 0.506 . . . . 0.0 111.602 175.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 99.3 mt -59.27 -42.31 90.9 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.873 -0.517 . . . . 0.0 112.367 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 38.6 pt -73.73 -29.46 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.131 0.878 . . . . 0.0 113.339 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.56 -14.16 57.18 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 119.962 1.256 . . . . 0.0 114.095 175.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.5 tt -87.95 -23.16 23.95 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.39 1.876 . . . . 0.0 111.497 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.75 21.67 33.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.44 1.019 . . . . 0.0 114.463 -177.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -100.58 53.19 0.87 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.039 1.4 . . . . 0.0 110.734 173.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -52.36 -37.92 57.46 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.774 1.63 . . . . 0.0 112.378 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.9 m -68.59 -15.44 63.53 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.042 1.737 . . . . 0.0 113.376 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -90.53 -33.66 15.84 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.37 -0.831 . . . . 0.0 111.588 165.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.6 -35.15 79.49 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.848 0.859 . . . . 0.0 113.13 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 pt -62.74 -36.39 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-N 119.229 0.922 . . . . 0.0 112.985 177.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -67.06 -41.98 85.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.211 0.605 . . . . 0.0 111.605 170.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 31.1 ttm -76.38 -29.52 57.17 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 79.5 m -70.79 -39.34 73.2 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.019 -1.051 . . . . 0.0 111.207 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -59.79 -44.03 94.14 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.107 0.867 . . . . 0.0 111.536 168.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -58.43 -35.29 71.88 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 175.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.41 -27.18 52.73 Favored Glycine 0 CA--C 1.536 1.349 0 CA-C-N 120.265 1.393 . . . . 0.0 114.415 174.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.7 mt -59.7 -32.74 70.8 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.266 2.033 . . . . 0.0 112.171 172.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -60.9 -17.61 51.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -85.51 -1.22 56.85 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.595 1.158 . . . . 0.0 112.942 175.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.7 p -106.0 22.06 16.27 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -162.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m -66.18 -32.79 74.44 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 p -104.8 166.65 10.24 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -174.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.87 -23.29 67.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.62 -22.83 64.2 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 120.828 -1.17 . . . . 0.0 112.656 174.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -124.17 17.46 9.15 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.21 1.804 . . . . 0.0 112.273 -169.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.09 -27.5 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 120.567 -1.333 . . . . 0.0 112.919 -178.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.97 63.81 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.284 -0.885 . . . . 0.0 111.038 171.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.8 mm -58.83 -30.72 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 124.165 0.986 . . . . 0.0 111.261 172.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.5 ttt85 -64.94 -38.26 90.39 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.939 -1.1 . . . . 0.0 113.013 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.5 t -68.37 -43.29 77.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.302 1.441 . . . . 0.0 111.529 167.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 12.3 tppt? -54.21 -53.44 53.53 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.94 0.896 . . . . 0.0 111.814 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -74.23 -31.1 62.46 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 120.098 1.317 . . . . 0.0 114.011 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -75.28 -36.03 61.24 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 120.743 1.611 . . . . 0.0 113.433 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.17 -38.58 82.24 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.805 1.639 . . . . 0.0 110.828 172.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 43.3 mmt-85 -56.06 -37.44 69.28 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 119.494 1.043 . . . . 0.0 111.627 172.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.8 tp -72.78 -42.83 63.53 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.263 1.025 . . . . 0.0 112.904 176.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -67.38 -23.66 65.61 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 175.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -97.77 -20.16 17.74 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.035 1.334 . . . . 0.0 114.211 174.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.27 -49.42 77.92 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.61 1.55 . . . . 0.0 109.498 163.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -64.44 -26.97 68.68 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.427 1.091 . . . . 0.0 112.484 171.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -80.81 -33.94 28.91 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.45 1.024 . . . . 0.0 115.406 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -93.88 -26.01 17.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.014 1.326 . . . . 0.0 112.926 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.2 p -67.8 -35.43 72.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 119.259 0.936 . . . . 0.0 111.75 170.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 155.46 100.96 0.18 Allowed Glycine 0 C--N 1.341 0.834 0 C-N-CA 124.497 1.046 . . . . 0.0 111.434 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 36.2 m -63.55 139.72 58.8 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.79 1.236 . . . . 0.0 113.207 -172.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 35.1 m -125.21 3.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.984 0 C-N-CA 125.824 1.649 . . . . 0.0 112.839 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -123.58 168.0 13.19 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.838 1.655 . . . . 0.0 112.739 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.0 mt 55.19 63.02 7.11 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 126.85 2.06 . . . . 0.0 111.206 -174.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -80.72 -17.23 9.91 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.8 2.334 . . . . 0.0 113.07 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.4 t 52.56 58.85 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.838 1.655 . . . . 0.0 113.191 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.2 m -141.37 -158.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 126.874 2.07 . . . . 0.0 110.512 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -73.55 163.97 27.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 122.489 1.138 . . . . 0.0 112.679 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.37 139.62 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -166.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -151.47 -54.62 0.14 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.594 1.958 . . . . 0.0 109.796 170.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -141.06 -62.31 0.48 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.89 1.676 . . . . 0.0 111.476 169.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.8 mp 60.41 170.26 0.07 OUTLIER Pre-proline 0 CA--C 1.559 1.294 0 C-N-CA 126.959 2.104 . . . . 0.0 114.961 168.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -60.3 157.52 35.17 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.851 2.367 . . . . 0.0 111.977 172.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.71 131.12 49.69 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.558 0.694 . . . . 0.0 112.483 -170.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.71 61.68 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.957 1.265 . . . . 0.0 115.706 179.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -63.3 -51.19 67.08 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.216 2.008 . . . . 0.0 112.18 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -158.05 153.03 25.31 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.596 1.558 . . . . 0.0 110.28 169.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 28.6 mmt85 -126.24 139.88 52.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.21 1.004 . . . . 0.0 112.153 176.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.1 p . . . . . 0 C--O 1.25 1.128 0 C-N-CA 127.879 2.471 . . . . 0.0 112.631 168.077 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . 0.525 ' HA ' ' HB2' ' A' ' 5' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -108.49 161.42 15.06 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -160.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -98.58 143.45 28.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.676 0.791 . . . . 0.0 111.437 168.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 30.2 t -121.85 104.68 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.019 1.328 . . . . 0.0 108.662 176.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 117.162 -1.399 . . . . 0.0 114.741 -162.803 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.3 m -57.42 -34.31 68.8 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -170.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -75.03 -20.89 59.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.43 1.014 . . . . 0.0 112.875 175.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.59 -17.9 55.38 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.596 -1.315 . . . . 0.0 113.18 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -74.16 -46.04 44.84 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.965 -1.084 . . . . 0.0 109.632 162.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.81 -43.1 80.65 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.596 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -72.48 -24.38 61.17 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 120.223 1.374 . . . . 0.0 113.689 -178.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . 0.264 10.9 ptpp? -77.85 -39.03 44.77 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 119.431 1.014 . . . . 0.0 112.71 169.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -65.14 -40.7 94.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.192 0.997 . . . . 0.0 112.277 170.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -60.85 -49.14 78.69 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.056 1.742 . . . . 0.0 111.34 176.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.07 -39.36 97.14 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 119.409 1.004 . . . . 0.0 113.134 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -61.03 -42.3 98.22 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.626 1.713 . . . . 0.0 111.948 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.3 m -61.1 -44.4 97.41 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.218 1.007 . . . . 0.0 111.415 174.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.5 mt -64.7 -38.92 92.62 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.747 1.219 . . . . 0.0 112.093 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -59.66 -35.68 74.9 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.599 1.091 . . . . 0.0 112.435 170.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.01 -19.88 64.96 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 174.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -100.79 3.7 42.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.313 1.045 . . . . 0.0 113.239 170.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.92 13.47 83.36 Favored Glycine 0 CA--C 1.536 1.359 0 O-C-N 121.122 -0.986 . . . . 0.0 114.768 -178.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 92.6 mt -87.71 56.32 3.86 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.202 1.801 . . . . 0.0 110.344 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -57.33 -39.56 76.12 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.486 1.114 . . . . 0.0 113.246 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.02 -39.35 75.85 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.95 0.795 . . . . 0.0 110.751 -178.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -64.63 -43.6 93.17 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.407 0.683 . . . . 0.0 111.045 173.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.31 76.81 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.876 0.871 . . . . 0.0 112.714 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.62 -38.48 75.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.013 0.925 . . . . 0.0 110.442 173.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -61.11 -42.99 99.55 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.089 0.859 . . . . 0.0 112.865 178.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 75.3 m -63.39 -35.13 79.37 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.764 0.826 . . . . 0.0 112.668 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -80.73 -34.15 34.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.28 1.032 . . . . 0.0 112.478 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -62.92 -34.61 77.8 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.211 0.914 . . . . 0.0 110.963 168.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -71.31 -17.65 62.44 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.5 mt -59.41 -46.48 88.58 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 119.678 1.126 . . . . 0.0 110.605 161.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.4 mt -77.24 -30.99 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.383 1.073 . . . . 0.0 111.206 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.1 m -62.64 -41.49 99.07 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 120.662 -1.274 . . . . 0.0 111.113 174.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.92 -30.26 61.2 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 174.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -137.78 62.02 32.45 Favored Pre-proline 0 CA--C 1.556 1.209 0 C-N-CA 124.542 1.137 . . . . 0.0 113.391 -167.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -61.89 -27.97 80.68 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.549 2.166 . . . . 0.0 116.429 -165.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -103.03 -1.43 29.26 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.186 0.995 . . . . 0.0 113.082 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -84.33 123.9 74.43 Favored Pre-proline 0 CA--C 1.543 0.695 0 O-C-N 120.878 -1.139 . . . . 0.0 112.179 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -55.24 -23.81 38.87 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.016 2.478 . . . . 0.0 114.928 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.72 -38.95 52.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.471 1.032 . . . . 0.0 112.844 174.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -69.08 -46.31 59.14 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 119.305 0.957 . . . . 0.0 111.521 -178.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -62.91 -40.46 97.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.47 1.108 . . . . 0.0 112.189 173.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.2 m -58.96 -34.5 71.85 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.241 1.016 . . . . 0.0 112.626 174.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.46 -44.19 17.79 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.794 0.838 . . . . 0.0 111.337 175.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -60.08 -34.7 73.81 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 121.087 1.767 . . . . 0.0 112.196 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.14 -34.18 77.06 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 168.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.1 tpt -66.11 -44.29 84.75 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.272 1.029 . . . . 0.0 111.727 172.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.62 -45.9 88.23 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.087 0.955 . . . . 0.0 112.065 174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.55 -36.02 77.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 118.789 -0.624 . . . . 0.0 112.666 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.1 pt -84.08 -17.24 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 173.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.15 -21.45 46.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.066 1.346 . . . . 0.0 112.049 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -88.2 -63.15 1.34 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.327 1.851 . . . . 0.0 109.542 172.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.66 15.77 0.73 Allowed Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.276 1.271 . . . . 0.0 116.276 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.06 59.71 1.98 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.304 1.552 . . . . 0.0 109.648 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.1 -30.33 68.02 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.602 1.161 . . . . 0.0 113.509 -173.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.7 m -70.11 -20.46 63.19 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.968 0.804 . . . . 0.0 112.176 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -79.09 -34.3 43.69 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 120.35 -1.469 . . . . 0.0 112.149 166.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.87 -45.5 64.3 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.8 pt -59.56 -40.49 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 CA-C-N 119.411 1.005 . . . . 0.0 111.857 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.0 tm0? -63.35 -49.08 75.31 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.461 1.104 . . . . 0.0 110.924 173.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 54.9 ttm -66.11 -28.14 68.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -64.69 -47.26 79.02 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.137 -0.977 . . . . 0.0 111.415 171.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -67.91 -36.09 79.59 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.932 0.493 . . . . 0.0 111.867 177.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.81 -35.43 74.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.544 0.738 . . . . 0.0 112.565 166.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -73.13 -28.56 66.14 Favored Glycine 0 N--CA 1.471 1.006 0 CA-C-N 120.17 1.35 . . . . 0.0 114.433 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.06 -26.05 68.66 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.371 1.585 . . . . 0.0 112.688 175.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -59.23 -16.96 24.03 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 125.103 1.361 . . . . 0.0 114.447 172.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -95.92 13.7 25.97 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.189 1.795 . . . . 0.0 113.967 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.258 16.4 p -122.51 -126.06 0.26 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.51 1.124 . . . . 0.0 113.171 -164.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 74.5 m 56.32 27.33 11.74 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 126.983 2.113 . . . . 0.0 116.475 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.6 t -149.38 154.21 38.57 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.534 -1.354 . . . . 0.0 113.04 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.89 66.94 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 -167.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -77.54 -6.73 54.65 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -124.22 6.97 8.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.512 1.525 . . . . 0.0 113.356 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -64.61 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.357 -1.464 . . . . 0.0 113.553 -173.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.93 -42.23 66.9 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.304 -0.873 . . . . 0.0 111.308 171.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.24 -41.0 68.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.05 0.94 . . . . 0.0 111.804 170.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 69.0 ttt-85 -58.18 -47.54 83.11 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.141 0.576 . . . . 0.0 109.868 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.3 m -65.17 -32.3 73.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 117.424 -1.274 . . . . 0.0 113.895 175.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -55.19 -48.33 73.95 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 120.674 1.579 . . . . 0.0 110.997 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -75.5 -29.02 59.39 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -61.18 -50.48 72.96 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.556 1.525 . . . . 0.0 111.828 170.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.84 -37.04 49.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 119.015 -0.517 . . . . 0.0 111.8 -174.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -59.48 -35.4 74.03 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 119.189 0.904 . . . . 0.0 111.588 174.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 27.9 tp -65.03 -45.96 83.28 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.224 0.92 . . . . 0.0 112.102 172.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.53 -26.78 63.73 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.3 tt -89.61 -28.72 19.34 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.832 0.742 . . . . 0.0 112.622 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.22 -46.05 86.59 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 120.534 1.516 . . . . 0.0 111.727 173.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.57 -23.87 67.41 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.686 0.794 . . . . 0.0 112.814 171.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -68.85 -55.96 10.2 Favored Glycine 0 CA--C 1.536 1.382 0 C-N-CA 126.833 2.159 . . . . 0.0 114.29 170.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.62 -25.98 64.2 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.138 -1.213 . . . . 0.0 113.221 -176.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.1 p -80.99 -9.56 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 O-C-N 121.212 -0.93 . . . . 0.0 113.219 168.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 75.44 9.15 84.48 Favored Glycine 0 CA--C 1.535 1.286 0 O-C-N 120.719 -1.238 . . . . 0.0 115.32 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.8 m -75.81 -1.64 26.13 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 118.783 1.292 . . . . 0.0 114.008 -177.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.3 t -60.32 131.97 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-N 119.268 0.94 . . . . 0.0 110.686 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -121.05 144.6 48.46 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.954 1.702 . . . . 0.0 110.388 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 31.2 mt 58.64 76.53 0.45 Allowed Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.881 1.672 . . . . 0.0 111.639 176.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -80.92 4.42 6.98 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.563 2.175 . . . . 0.0 114.129 -174.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.2 t 62.26 65.67 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 125.948 1.699 . . . . 0.0 112.477 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.0 t -142.72 89.22 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 124.489 1.116 . . . . 0.0 111.111 -175.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 48.13 -63.65 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 130.104 3.362 . . . . 0.0 118.971 165.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.3 p -166.39 -34.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 126.936 2.094 . . . . 0.0 112.755 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.76 -41.62 64.89 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.52 1.674 . . . . 0.0 115.52 -162.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -115.68 26.11 10.27 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.187 -0.946 . . . . 0.0 113.243 -164.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mt -105.3 160.37 26.26 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 125.791 1.636 . . . . 0.0 110.139 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -62.46 -24.62 75.57 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.727 2.285 . . . . 0.0 115.234 -176.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -147.32 -46.21 0.17 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.17 0.988 . . . . 0.0 113.248 168.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 170.21 27.95 0.02 OUTLIER Glycine 0 CA--C 1.536 1.398 0 N-CA-C 116.579 1.391 . . . . 0.0 116.579 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -51.81 -36.96 49.83 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 -167.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.16 -29.44 65.21 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.769 -1.207 . . . . 0.0 113.719 177.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 42.35 76.34 0.08 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 128.471 2.708 . . . . 0.0 115.455 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 63.2 m . . . . . 0 C--O 1.251 1.15 0 C-N-CA 124.83 1.252 . . . . 0.0 113.546 171.602 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 14.5 mmt . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 119.803 -0.141 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 63.6 mm-40 -108.78 165.52 11.5 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.951 1.3 . . . . 0.0 111.47 175.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -158.47 153.61 25.45 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 120.399 -1.438 . . . . 0.0 114.775 175.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.68 179.18 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 127.209 2.204 . . . . 0.0 112.821 167.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.796 1.638 . . . . 0.0 115.134 -174.457 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 tmm? . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 121.386 0.612 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.4 m -66.52 -39.7 88.77 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.23 1.412 . . . . 0.0 114.345 -161.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -63.45 -22.18 66.74 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -178.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -95.89 -38.87 10.08 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.705 1.138 . . . . 0.0 112.802 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -66.02 -16.12 63.63 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.89 -33.15 22.84 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.901 0.881 . . . . 0.0 113.37 166.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -70.38 -36.56 74.18 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.324 -0.86 . . . . 0.0 112.189 -172.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.7 ptpt -57.7 -41.04 80.89 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.438 1.095 . . . . 0.0 112.651 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -69.67 -34.52 74.1 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.043 0.537 . . . . 0.0 111.971 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -65.24 -34.4 78.27 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.259 1.024 . . . . 0.0 111.537 169.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.42 -49.19 58.19 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.294 1.426 . . . . 0.0 113.952 170.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -55.29 -34.63 64.29 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 118.632 1.216 . . . . 0.0 110.951 171.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.9 t -70.63 -40.62 72.99 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.46 1.104 . . . . 0.0 113.487 172.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.3 mt -57.34 -41.09 79.33 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.22 1.373 . . . . 0.0 111.314 174.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.527 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 83.8 m-85 -58.46 -39.98 81.41 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.132 0.878 . . . . 0.0 111.703 170.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -31.3 72.46 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.719 1.208 . . . . 0.0 114.079 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -80.71 -8.01 59.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.738 1.215 . . . . 0.0 113.761 171.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.495 ' HA2' ' CE1' ' A' ' 20' ' ' TYR . . . 91.16 6.2 66.91 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.995 -1.066 . . . . 0.0 114.437 -173.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 47.2 mt -82.86 44.51 0.92 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.49 1.516 . . . . 0.0 110.615 -177.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.495 ' CE1' ' HA2' ' A' ' 18' ' ' GLY . 5.0 m-85 -55.76 -34.86 65.6 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 113.032 -168.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -76.84 -35.52 57.46 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-N 120.503 1.502 . . . . 0.0 112.116 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.13 -24.48 62.28 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.206 0.603 . . . . 0.0 112.268 168.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB1' ' CE2' ' A' ' 15' ' ' PHE . . . -79.92 -35.47 37.78 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.958 0.903 . . . . 0.0 113.105 174.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.97 -40.36 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 O-C-N 121.015 -1.053 . . . . 0.0 110.402 168.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -55.01 -35.84 64.81 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.122 0.569 . . . . 0.0 112.026 169.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.2 t -67.81 -50.86 54.54 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.726 175.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.23 -34.98 76.01 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.536 1.062 . . . . 0.0 111.58 178.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -62.21 -29.77 70.61 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.611 0.764 . . . . 0.0 112.679 174.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -65.93 -39.78 90.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.245 1.384 . . . . 0.0 111.714 171.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.5 mt -64.54 -37.63 88.22 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.855 -0.528 . . . . 0.0 110.511 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.6 mt -80.33 -20.72 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 C-N-CA 125.458 1.503 . . . . 0.0 111.533 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.4 m -78.55 -44.44 24.21 Favored 'General case' 0 N--CA 1.48 1.051 0 O-C-N 120.156 -1.59 . . . . 0.0 111.588 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -91.57 -20.66 21.44 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -133.92 62.26 56.63 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 124.833 1.253 . . . . 0.0 112.169 173.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -57.45 -27.49 76.33 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 123.994 3.129 . . . . 0.0 118.699 -164.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -115.48 11.97 16.1 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 178.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.416 ' HB3' HG12 ' A' ' 39' ' ' VAL . 3.9 m120 -76.01 134.73 71.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 O-C-N 121.57 -0.706 . . . . 0.0 110.479 170.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' HB2' HG21 ' A' ' 76' ' ' ILE . 43.8 Cg_endo -55.54 -25.56 50.19 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.638 2.892 . . . . 0.0 113.932 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.416 HG12 ' HB3' ' A' ' 37' ' ' ASN . 6.0 p -55.01 -44.71 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 C-N-CA 125.339 1.456 . . . . 0.0 113.687 -175.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.04 -36.61 91.04 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -69.24 -36.68 77.44 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.122 0.969 . . . . 0.0 111.673 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 22.7 t -64.42 -42.91 95.78 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.361 -0.837 . . . . 0.0 112.278 172.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -75.43 -24.27 57.04 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -72.78 -37.43 67.61 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.212 1.005 . . . . 0.0 112.095 168.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.96 89.34 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.069 -1.019 . . . . 0.0 111.829 169.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.507 ' SD ' ' HE2' ' A' ' 50' ' ' LYS . 33.3 tpp -62.28 -45.53 92.84 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.013 0.925 . . . . 0.0 112.135 171.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -56.26 -43.4 78.68 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.498 -0.751 . . . . 0.0 112.317 173.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.82 -41.03 92.32 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.699 0.8 . . . . 0.0 112.683 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 43.0 pt -68.85 -35.67 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.407 1.458 . . . . 0.0 112.287 172.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.507 ' HE2' ' SD ' ' A' ' 46' ' ' MET . 0.2 OUTLIER -74.05 4.73 5.08 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 173.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.9 mt -122.19 3.55 9.82 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 128.26 2.624 . . . . 0.0 113.425 167.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.1 14.23 77.46 Favored Glycine 0 CA--C 1.538 1.473 0 N-CA-C 116.329 1.292 . . . . 0.0 116.329 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -96.57 47.19 1.06 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.239 1.816 . . . . 0.0 111.86 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -60.05 -34.77 73.87 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.987 -1.071 . . . . 0.0 112.845 -171.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.4 m -64.32 -25.55 68.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.627 1.171 . . . . 0.0 112.532 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -81.29 -41.18 22.53 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 118.437 0.562 . . . . 0.0 111.054 169.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.76 88.54 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -175.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 28.2 pt -64.73 -35.15 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.779 0.718 . . . . 0.0 112.498 174.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -72.22 -44.23 63.24 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.782 0.833 . . . . 0.0 111.046 173.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 55.4 ttm -62.52 -30.02 70.99 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.885 0.874 . . . . 0.0 112.75 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 91.1 m -65.85 -39.14 90.48 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 120.99 -1.069 . . . . 0.0 112.113 171.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -70.67 -39.87 73.3 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.858 0.863 . . . . 0.0 112.077 176.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.07 -35.59 77.36 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.361 0.664 . . . . 0.0 111.529 166.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.22 -31.21 78.48 Favored Glycine 0 CA--C 1.527 0.818 0 O-C-N 120.539 -1.351 . . . . 0.0 113.279 175.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 98.2 mt -63.56 -29.18 70.47 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.032 1.416 . . . . 0.0 112.808 173.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -66.39 -8.03 23.03 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 170.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -102.68 11.59 37.48 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.036 1.735 . . . . 0.0 112.606 168.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 30.8 p -126.97 19.28 7.1 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.568 1.547 . . . . 0.0 113.932 -178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 m -81.8 3.83 24.44 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.897 1.279 . . . . 0.0 113.725 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 t -143.26 150.56 39.44 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.022 1.729 . . . . 0.0 111.328 -166.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.2 -26.1 37.11 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 116.945 2.202 . . . . 0.0 116.945 -161.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -74.61 -4.81 39.34 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.736 1.153 . . . . 0.0 113.97 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -135.51 11.78 3.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.787 1.235 . . . . 0.0 113.908 -168.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.01 -9.36 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 O-C-N 120.322 -1.486 . . . . 0.0 114.94 -175.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.48 -35.93 24.52 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.39 0.996 . . . . 0.0 110.459 158.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.479 HG21 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm -62.28 -27.89 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 O-C-N 120.866 -1.146 . . . . 0.0 112.041 174.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -48.35 -38.88 20.32 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.727 1.211 . . . . 0.0 112.438 168.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.7 m -79.36 -35.34 41.05 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.225 1.01 . . . . 0.0 113.465 170.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.437 ' HE2' ' SD ' ' B' ' -4' ' ' MET 0.272 20.9 ttpt -73.69 9.66 1.37 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 170.464 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -108.89 -32.05 7.43 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.723 -1.236 . . . . 0.0 112.855 152.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -81.89 -31.39 31.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.51 -36.15 82.99 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 121.07 1.759 . . . . 0.0 110.191 163.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -63.55 -35.59 80.98 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.521 1.128 . . . . 0.0 111.446 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 21.3 tp -64.18 -45.04 90.11 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.014 1.325 . . . . 0.0 112.576 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -63.57 -32.53 74.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.058 -1.026 . . . . 0.0 113.062 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.9 -29.07 32.54 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.516 1.527 . . . . 0.0 112.499 178.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.02 -44.82 75.63 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.536 -1.352 . . . . 0.0 111.182 168.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -57.7 -27.34 62.84 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.793 0.837 . . . . 0.0 111.657 165.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.27 -61.8 6.26 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 128.885 3.136 . . . . 0.0 113.234 172.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -70.14 -31.28 68.72 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.866 1.266 . . . . 0.0 113.268 -174.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.8 p -75.43 -29.96 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.462 0.574 . . . . 0.0 111.742 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -75.9 -109.33 0.12 Allowed Glycine 0 CA--C 1.53 1.026 0 C-N-CA 125.304 1.43 . . . . 0.0 111.949 171.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 39.7 m 58.95 31.61 21.5 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.76 1.224 . . . . 0.0 114.201 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -96.13 117.63 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 120.703 -1.248 . . . . 0.0 109.5 169.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -76.16 149.12 37.36 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.829 0.851 . . . . 0.0 112.554 -175.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 59.1 mt 62.11 88.49 0.12 Allowed Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 126.157 1.783 . . . . 0.0 110.407 -168.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.4 -9.83 10.14 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.296 2.664 . . . . 0.0 114.197 -175.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.9 t 55.56 69.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 CA-C-O 123.133 1.444 . . . . 0.0 112.847 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.3 m -136.39 153.53 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 126.675 1.99 . . . . 0.0 109.586 -178.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -63.12 -47.13 84.09 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 118.583 0.629 . . . . 0.0 112.66 -167.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.5 m -145.72 140.71 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 126.964 2.106 . . . . 0.0 109.198 165.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -165.8 -128.91 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.942 1.297 . . . . 0.0 109.489 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -109.03 -43.83 4.1 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.904 1.682 . . . . 0.0 112.603 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 5.4 mp 56.58 -178.92 0.03 OUTLIER Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 176.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -57.23 163.84 7.55 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 121.965 1.777 . . . . 0.0 114.028 170.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -62.76 124.39 20.9 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.816 -1.178 . . . . 0.0 111.837 -176.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.72 -1.76 61.27 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.627 1.584 . . . . 0.0 115.831 -176.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -71.25 -53.26 14.94 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.037 1.419 . . . . 0.0 113.783 -169.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -151.05 113.79 4.7 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.218 1.008 . . . . 0.0 113.529 169.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -111.97 21.44 15.93 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.706 2.002 . . . . 0.0 113.471 -174.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 68.1 m . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.49 1.916 . . . . 0.0 112.119 -158.988 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . 0.437 ' SD ' ' HE2' ' A' ' 79' ' ' LYS . 10.2 ttt . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.61 157.06 38.15 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.635 2.087 . . . . 0.0 116.635 -156.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -149.86 179.31 8.14 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.593 2.357 . . . . 0.0 109.832 163.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 39.2 t -84.65 103.02 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 O-C-N 120.462 -1.399 . . . . 0.0 111.434 175.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 . . . . . 0 C--O 1.254 1.333 0 C-N-CA 127.304 2.242 . . . . 0.0 113.996 179.769 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.6 mtt . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -63.43 -39.11 93.6 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -162.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.41 -30.69 71.73 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 119.928 1.24 . . . . 0.0 112.337 178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.37 -39.31 59.33 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 176.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.308 9.7 pt-20 -75.75 -10.0 59.06 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.33 0.968 . . . . 0.0 112.941 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -75.13 -57.53 3.84 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.254 1.422 . . . . 0.0 111.656 156.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -65.07 -34.93 79.59 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -167.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.9 ptmt -65.18 -19.87 66.18 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 176.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -105.69 -21.36 13.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.616 1.566 . . . . 0.0 113.178 177.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -55.45 -34.73 64.75 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 120.158 1.345 . . . . 0.0 111.334 163.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -57.79 -28.96 61.02 Favored Glycine 0 CA--C 1.539 1.59 0 CA-C-O 119.016 -0.88 . . . . 0.0 114.724 172.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -60.76 -49.79 76.09 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.752 1.776 . . . . 0.0 111.87 174.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.5 t -68.92 -30.0 68.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 120.344 -0.543 . . . . 0.0 111.718 179.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 76.6 mt -64.31 -41.49 96.8 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.573 -1.329 . . . . 0.0 112.172 172.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -61.1 -34.94 75.75 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.376 -0.827 . . . . 0.0 112.643 168.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.2 -22.85 51.74 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -78.33 -26.31 46.8 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.436 1.094 . . . . 0.0 111.867 164.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.2 14.16 39.89 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.407 1.003 . . . . 0.0 113.951 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 97.3 mt -88.43 58.62 4.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 127.228 2.211 . . . . 0.0 109.367 178.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -57.47 -36.45 71.48 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.782 0.833 . . . . 0.0 112.911 -172.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -79.86 -28.5 40.0 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.532 1.06 . . . . 0.0 111.553 -176.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -69.49 -38.11 77.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.664 0.785 . . . . 0.0 112.412 163.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.23 -32.93 74.3 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 176.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.6 t -69.01 -38.97 79.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 124.138 0.975 . . . . 0.0 111.033 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -60.73 -33.77 73.41 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.141 -0.974 . . . . 0.0 113.002 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.2 p -74.01 -34.86 64.31 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 117.763 -1.113 . . . . 0.0 113.942 173.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . 0.251 0.2 OUTLIER -67.09 -33.92 76.51 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.136 1.789 . . . . 0.0 111.693 169.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -62.53 -28.34 69.78 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.413 -0.804 . . . . 0.0 111.892 175.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -68.36 -33.8 74.93 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.709 -1.244 . . . . 0.0 112.539 173.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.63 -44.27 62.16 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 118.881 0.764 . . . . 0.0 109.19 177.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.0 mt -70.85 -20.63 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 124.073 0.949 . . . . 0.0 112.103 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.5 m -68.63 -39.83 80.6 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.416 -1.428 . . . . 0.0 111.431 168.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -90.3 -28.22 18.91 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -177.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -132.29 60.26 49.64 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 126.151 1.78 . . . . 0.0 111.96 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -59.86 -26.56 82.66 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.195 2.596 . . . . 0.0 115.983 -170.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -106.97 4.44 27.17 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.492 1.517 . . . . 0.0 112.339 -170.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -93.13 130.32 36.4 Favored Pre-proline 0 CA--C 1.542 0.657 0 O-C-N 120.813 -1.179 . . . . 0.0 112.969 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.41 -24.05 73.0 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.754 2.303 . . . . 0.0 114.107 174.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.49 -30.33 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 173.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.62 -42.35 55.01 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.357 -0.839 . . . . 0.0 111.121 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.45 -29.87 61.64 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 26.5 p -66.15 -42.9 88.42 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 120.105 1.321 . . . . 0.0 111.206 172.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -67.9 -44.51 76.81 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.475 0.71 . . . . 0.0 111.479 176.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -59.22 -41.91 89.76 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.851 0.86 . . . . 0.0 112.399 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.81 -37.29 86.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.379 0.991 . . . . 0.0 112.505 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.6 tpt -70.02 -39.58 75.71 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.626 0.648 . . . . 0.0 111.927 175.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.73 99.06 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.756 0.822 . . . . 0.0 111.735 172.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.7 mt -59.84 -45.04 93.65 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.581 -0.699 . . . . 0.0 111.506 176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 29.3 pt -68.44 -30.45 47.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 120.028 1.286 . . . . 0.0 112.87 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.71 -11.37 59.85 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 175.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.6 tt -88.97 -29.08 19.79 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.07 1.748 . . . . 0.0 111.084 164.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 107.27 15.42 15.89 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.687 1.613 . . . . 0.0 114.695 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.93 48.71 1.06 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.312 2.245 . . . . 0.0 110.751 -178.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -59.85 -32.6 70.85 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.67 -1.269 . . . . 0.0 112.974 -173.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 55.4 m -55.82 -31.35 62.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.162 1.785 . . . . 0.0 112.787 171.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 56.6 mm-40 -79.5 -39.08 32.9 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.669 0.788 . . . . 0.0 111.206 174.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.43 -39.61 89.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.869 0.868 . . . . 0.0 112.758 -176.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.4 pt -65.2 -30.54 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.262 0.937 . . . . 0.0 112.912 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 tm0? -77.35 -36.23 53.96 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.988 0.915 . . . . 0.0 111.698 171.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.9 ttm -66.65 -30.97 71.36 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 120.966 -1.084 . . . . 0.0 112.561 173.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 86.8 m -61.92 -43.16 99.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.321 -0.862 . . . . 0.0 111.927 171.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -65.94 -40.0 90.97 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.756 1.223 . . . . 0.0 112.916 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.26 -27.68 69.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.153 0.581 . . . . 0.0 112.312 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -81.25 -22.17 61.25 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 120.606 -1.309 . . . . 0.0 114.717 174.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.618 ' CD2' HE22 ' A' ' 81' ' ' GLN . 42.4 mt -59.21 -27.35 65.65 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.847 1.824 . . . . 0.0 112.263 171.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -59.88 -10.76 4.33 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.397 1.879 . . . . 0.0 115.458 174.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -124.28 42.0 3.36 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.331 1.853 . . . . 0.0 112.712 -168.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 66.2 p -129.88 -12.68 4.21 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 116.665 2.098 . . . . 0.0 116.665 -164.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 60.4 m -81.64 49.46 1.33 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 -168.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.2 t -164.07 153.35 13.96 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.904 1.681 . . . . 0.0 110.518 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.77 -11.08 32.73 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 120.993 -1.067 . . . . 0.0 113.139 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -63.49 -31.82 73.09 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.618 1.167 . . . . 0.0 111.932 165.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -130.87 16.87 5.19 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.238 1.415 . . . . 0.0 113.82 -169.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.6 p -69.98 -28.1 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 120.505 -1.372 . . . . 0.0 113.069 178.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.65 -34.99 22.93 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.36 0.664 . . . . 0.0 111.294 170.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 12.8 mm -51.38 -41.72 26.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 121.468 -0.77 . . . . 0.0 111.052 166.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -55.26 -47.33 75.62 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.847 0.749 . . . . 0.0 111.533 176.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.6 m -61.86 -42.29 98.87 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.975 1.31 . . . . 0.0 111.875 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -70.32 -4.02 20.13 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.577 1.551 . . . . 0.0 114.153 175.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -102.76 -31.62 10.23 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.8 1.182 . . . . 0.0 112.983 157.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.618 HE22 ' CD2' ' A' ' 65' ' ' LEU . 10.7 mm-40 -61.12 -53.59 55.14 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 120.837 1.653 . . . . 0.0 112.079 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.86 -33.65 68.59 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.288 0.495 . . . . 0.0 111.105 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 tpp85 -66.3 -33.2 75.21 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.678 1.191 . . . . 0.0 111.684 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 tt -66.82 -50.78 61.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.39 0.676 . . . . 0.0 110.445 169.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.03 -37.16 71.36 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 177.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.32 -26.35 35.7 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.925 1.29 . . . . 0.0 112.689 178.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.71 -42.62 90.89 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.743 1.61 . . . . 0.0 110.484 169.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -64.51 -29.54 70.57 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.453 0.701 . . . . 0.0 111.274 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.93 -60.33 8.61 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 127.756 2.598 . . . . 0.0 113.694 172.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.61 -27.24 68.51 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.419 1.887 . . . . 0.0 113.027 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p -93.68 -18.21 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 80.03 27.41 53.12 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 124.547 1.07 . . . . 0.0 114.703 -178.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.1 m -78.19 89.74 4.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.734 1.267 . . . . 0.0 111.202 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 13.0 p -148.16 148.88 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 125.283 1.433 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -135.57 173.72 11.4 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.641 1.577 . . . . 0.0 110.966 173.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.5 mt 47.83 65.43 7.04 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 125.954 1.702 . . . . 0.0 110.516 -174.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -83.24 -0.02 9.74 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.41 2.074 . . . . 0.0 113.059 -174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 t 53.26 49.56 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.233 1.413 . . . . 0.0 112.617 176.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 27.3 m -130.72 41.75 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 126.534 1.934 . . . . 0.0 111.051 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . 0.259 3.4 mp0 67.84 171.27 0.27 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 128.436 2.695 . . . . 0.0 115.922 174.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 16.2 m -64.35 -8.08 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -159.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -84.14 -8.2 59.16 Favored 'General case' 0 CA--C 1.553 1.091 0 O-C-N 120.512 -1.368 . . . . 0.0 112.161 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -130.47 -14.24 3.74 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 173.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 88.3 mt -64.7 164.13 22.95 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 120.877 -1.139 . . . . 0.0 111.949 165.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -56.01 151.86 39.8 Favored 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 123.335 2.69 . . . . 0.0 113.843 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -63.69 120.75 12.41 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.297 -0.877 . . . . 0.0 111.266 178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.17 -6.31 79.92 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 125.628 1.585 . . . . 0.0 115.898 -174.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -87.14 128.86 35.12 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.86 1.83 . . . . 0.0 111.842 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.0 t0 56.79 172.79 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.235 1.814 . . . . 0.0 114.763 -174.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -142.52 152.78 43.0 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.255 1.822 . . . . 0.0 111.86 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.251 1.136 0 C-N-CA 126.061 1.744 . . . . 0.0 111.551 172.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -73.6 -0.82 16.45 Favored 'General case' 0 CA--C 1.55 0.948 0 N-CA-C 115.616 1.709 . . . . 0.0 115.616 -173.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 61.37 -118.31 0.71 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.352 1.861 . . . . 0.0 112.374 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 54.8 t -133.62 90.23 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.467 1.507 . . . . 0.0 108.457 -170.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . 0.323 0.2 OUTLIER . . . . . 0 C--O 1.254 1.304 0 C-N-CA 128.213 2.605 . . . . 0.0 115.277 -172.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.876 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.6 p -67.94 -22.63 65.04 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 120.051 -1.655 . . . . 0.0 114.051 -176.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -65.04 -39.29 93.13 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 119.469 1.031 . . . . 0.0 111.309 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.76 -15.42 60.76 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 174.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -75.49 -50.89 14.33 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.756 -1.215 . . . . 0.0 111.429 164.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.276 0.0 OUTLIER -67.22 -29.4 69.04 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.853 1.206 . . . . 0.0 113.658 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.34 -39.14 71.51 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.023 1.283 . . . . 0.0 112.764 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -65.99 -20.44 66.19 Favored 'General case' 0 N--CA 1.485 1.289 0 O-C-N 120.886 -1.134 . . . . 0.0 113.111 175.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -95.54 -32.44 12.84 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.096 0.958 . . . . 0.0 112.568 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -59.07 -42.94 91.55 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.253 1.021 . . . . 0.0 111.045 170.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -53.6 -39.65 61.12 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-N 118.82 0.736 . . . . 0.0 113.753 173.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -70.1 -39.9 75.24 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.607 1.204 . . . . 0.0 111.178 177.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.3 t -60.29 -43.08 96.58 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 122.782 0.433 . . . . 0.0 111.426 172.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.8 mt -59.38 -40.66 87.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.222 -0.924 . . . . 0.0 111.652 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.0 m-85 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 120.141 1.337 . . . . 0.0 113.022 170.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.471 ' HE2' ' N ' ' A' ' 16' ' ' LYS . 1.1 mpmm? -68.11 -18.21 64.58 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 175.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -91.89 -7.14 50.08 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.912 1.285 . . . . 0.0 113.124 166.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.21 9.22 86.84 Favored Glycine 0 CA--C 1.535 1.311 0 O-C-N 121.136 -0.977 . . . . 0.0 114.965 -175.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.0 mt -80.23 46.86 0.86 Allowed 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.888 2.075 . . . . 0.0 111.893 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -50.7 -41.68 56.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.012 1.725 . . . . 0.0 113.431 -173.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -73.28 -27.4 61.54 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.288 0.949 . . . . 0.0 111.76 -175.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -81.88 -36.07 28.58 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.507 0.723 . . . . 0.0 111.065 170.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.24 71.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.624 1.17 . . . . 0.0 113.079 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.7 t -56.98 -40.86 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.771 1.228 . . . . 0.0 110.922 177.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.61 -42.07 98.36 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.249 -0.882 . . . . 0.0 112.538 176.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -61.26 -46.21 91.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 0.0 112.149 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -65.46 -33.23 75.45 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 175.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -69.62 -28.04 65.58 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.708 0.686 . . . . 0.0 112.362 172.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -66.42 -31.65 72.54 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.525 1.057 . . . . 0.0 112.096 173.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.3 mt -58.3 -37.7 75.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.423 1.011 . . . . 0.0 111.209 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -79.51 -22.92 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 122.711 0.405 . . . . 0.0 111.888 177.132 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -69.77 -41.46 75.14 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 120.798 -1.189 . . . . 0.0 111.083 169.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.21 -34.54 23.9 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -176.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -124.67 66.56 47.52 Favored Pre-proline 0 CA--C 1.559 1.3 0 C-N-CA 125.345 1.458 . . . . 0.0 112.697 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -58.39 -22.4 58.31 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.632 2.888 . . . . 0.0 119.01 -166.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 -122.23 16.3 10.65 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.54 1.064 . . . . 0.0 112.653 -179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.7 m120 -89.5 124.29 64.65 Favored Pre-proline 0 CA--C 1.541 0.63 0 O-C-N 120.724 -1.235 . . . . 0.0 111.215 174.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.24 -16.35 53.9 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.417 2.078 . . . . 0.0 113.949 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.48 HG12 ' HB3' ' A' ' 37' ' ' ASN . 4.4 p -51.58 -46.77 37.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.56 1.073 . . . . 0.0 111.892 171.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.26 -43.42 92.95 Favored Glycine 0 C--N 1.34 0.766 0 C-N-CA 123.522 0.582 . . . . 0.0 111.934 -176.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -58.89 -37.81 77.44 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 117.611 0.705 . . . . 0.0 112.431 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.4 p -65.35 -38.05 88.93 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.774 -1.204 . . . . 0.0 112.886 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -76.02 -37.11 58.79 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.83 0.852 . . . . 0.0 111.995 178.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -71.18 -33.46 70.01 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 120.9 -1.125 . . . . 0.0 112.505 175.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.43 -37.43 83.49 Favored 'General case' 0 CA--C 1.544 0.715 0 O-C-N 120.922 -1.112 . . . . 0.0 111.717 166.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.4 tpt -63.35 -43.45 97.67 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.128 0.571 . . . . 0.0 111.812 173.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.16 -44.78 83.8 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.084 0.954 . . . . 0.0 112.1 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -64.18 -34.25 77.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.75 0.82 . . . . 0.0 112.848 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 30.3 pt -80.54 -17.14 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 119.735 1.152 . . . . 0.0 114.07 171.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.41 -13.13 53.03 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.466 1.506 . . . . 0.0 113.222 171.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 tt -101.82 -38.68 7.74 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.914 2.086 . . . . 0.0 112.077 173.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 112.19 22.44 5.88 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 124.726 1.155 . . . . 0.0 115.678 176.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -103.75 53.89 0.75 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.598 1.19 . . . . 0.0 109.094 169.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -56.51 -34.0 66.57 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 112.83 -173.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 27.9 m -64.82 -26.34 68.3 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.89 0.768 . . . . 0.0 112.144 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -75.62 -33.4 60.51 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 121.034 -1.041 . . . . 0.0 112.015 169.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.0 -40.59 71.76 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 112.75 -179.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 25.4 pt -65.79 -36.6 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.938 0.79 . . . . 0.0 112.068 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -62.38 -46.83 86.85 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.882 0.873 . . . . 0.0 110.985 170.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 50.3 ttm -62.2 -32.28 72.91 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.59 -0.693 . . . . 0.0 112.834 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.73 -49.53 62.13 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.051 -1.031 . . . . 0.0 112.031 174.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.43 -33.96 77.17 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 122.971 0.509 . . . . 0.0 111.811 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.31 -26.37 68.03 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.462 1.505 . . . . 0.0 113.349 169.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.44 -31.55 37.06 Favored Glycine 0 N--CA 1.473 1.124 0 O-C-N 120.335 -1.478 . . . . 0.0 114.11 172.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.0 -32.01 70.46 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.611 1.705 . . . . 0.0 112.161 176.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -52.77 -22.63 5.53 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.48 1.512 . . . . 0.0 114.581 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -81.42 -12.83 58.81 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.439 1.495 . . . . 0.0 114.145 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.2 p -103.03 10.57 38.04 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 118.188 2.662 . . . . 0.0 118.188 -148.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.8 m -76.71 37.24 0.17 Allowed 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -178.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.5 t -151.59 148.55 28.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.591 1.556 . . . . 0.0 111.278 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.31 -15.47 16.24 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 172.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -67.77 -26.83 66.31 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.174 0.897 . . . . 0.0 112.111 169.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -128.03 17.09 6.72 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 125.683 1.593 . . . . 0.0 113.665 -174.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.2 p -63.42 -31.17 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 O-C-N 120.093 -1.63 . . . . 0.0 112.595 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -80.02 -10.5 59.77 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.02 1.328 . . . . 0.0 113.756 174.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.3 mm -84.3 -35.85 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 124.829 1.251 . . . . 0.0 110.339 168.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -57.2 -39.35 75.24 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.694 1.198 . . . . 0.0 111.731 176.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.2 p -71.14 -47.5 57.49 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.082 0.953 . . . . 0.0 112.544 171.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.7 mttm -48.56 -57.26 6.45 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.403 1.002 . . . . 0.0 111.838 176.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -70.15 -30.07 67.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 117.979 -1.01 . . . . 0.0 112.976 -173.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -76.55 -38.06 55.63 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.651 1.569 . . . . 0.0 113.602 175.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.23 -39.2 65.67 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.703 1.138 . . . . 0.0 111.321 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . 0.369 15.6 ptp180 -77.04 -11.24 59.78 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.448 1.476 . . . . 0.0 114.412 176.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 25.5 tp -75.5 -41.44 55.32 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.248 1.019 . . . . 0.0 112.171 161.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -59.62 -39.19 83.45 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.104 -0.998 . . . . 0.0 111.343 167.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.47 -28.05 41.54 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.394 1.078 . . . . 0.0 113.572 179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.33 -46.72 89.07 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.751 1.16 . . . . 0.0 110.986 167.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.0 -26.96 68.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.839 0.856 . . . . 0.0 111.423 170.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.28 -49.65 55.82 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 126.728 2.109 . . . . 0.0 114.421 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.99 -27.14 61.62 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.611 -0.935 . . . . 0.0 112.562 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 p -90.16 -12.17 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 177.45 164.46 31.03 Favored Glycine 0 CA--C 1.541 1.698 0 C-N-CA 124.518 1.056 . . . . 0.0 114.234 174.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.8 m -128.88 3.45 5.37 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -169.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 13.6 p -111.33 118.54 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.247 1.019 . . . . 0.0 109.411 161.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.62 72.07 1.38 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.141 1.377 . . . . 0.0 111.667 -161.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.2 mt -79.07 115.04 49.57 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 168.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.73 -13.68 27.0 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.517 2.812 . . . . 0.0 113.392 177.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . 0.302 30.8 m 53.47 21.75 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 116.843 2.164 . . . . 0.0 116.843 174.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 97.6 t -133.79 -22.92 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 125.273 1.429 . . . . 0.0 114.086 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -170.71 168.16 7.52 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.777 1.631 . . . . 0.0 113.589 179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 60.8 t -80.89 88.88 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 126.728 2.011 . . . . 0.0 109.583 162.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -118.21 -69.69 0.84 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.836 1.254 . . . . 0.0 111.555 175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -107.2 -60.2 1.72 Allowed 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.613 -0.68 . . . . 0.0 110.416 173.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.9 mt 61.91 166.25 0.1 Allowed Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.839 2.056 . . . . 0.0 113.637 -175.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.74 169.59 19.8 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 121.99 1.794 . . . . 0.0 113.497 160.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -64.85 131.87 47.91 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.037 0.935 . . . . 0.0 112.307 172.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.61 -0.65 89.5 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 124.88 1.229 . . . . 0.0 115.931 173.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -89.82 -32.46 16.91 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 118.943 1.372 . . . . 0.0 112.918 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -149.15 170.34 18.64 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 125.877 1.671 . . . . 0.0 108.01 156.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -129.6 151.66 49.97 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -170.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.757 2.023 . . . . 0.0 112.995 -170.17 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 N--CA 1.481 1.092 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.207 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -91.93 136.66 32.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.997 0.919 . . . . 0.0 112.673 -168.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -78.36 146.83 34.43 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.545 1.138 . . . . 0.0 113.387 -175.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . 0.554 HG22 ' H ' ' B' ' 0' ' ' ASP . 2.7 p -100.22 176.17 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.856 1.662 . . . . 0.0 113.195 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . 0.554 ' H ' HG22 ' B' ' -1' ' ' VAL . 24.8 t0 . . . . . 0 C--O 1.252 1.231 0 C-N-CA 127.929 2.492 . . . . 0.0 113.97 -172.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 m -51.31 -23.9 4.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -173.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.3 mp0 -44.77 -36.45 3.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.52 1.528 . . . . 0.0 114.012 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.08 -34.52 26.13 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.614 1.097 . . . . 0.0 112.981 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -64.06 -23.51 67.35 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.502 1.521 . . . . 0.0 112.535 167.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.85 -46.34 25.07 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 125.962 1.705 . . . . 0.0 111.314 171.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -70.51 -27.25 64.04 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -174.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -62.53 -29.19 70.39 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 119.303 0.956 . . . . 0.0 112.967 167.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -85.83 -30.21 23.15 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 172.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.13 -43.88 91.99 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.983 -1.073 . . . . 0.0 111.091 171.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.22 91.44 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-O 119.231 -0.76 . . . . 0.0 114.079 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -55.21 -54.05 48.32 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.551 1.175 . . . . 0.0 110.358 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.6 t -57.86 -43.69 86.13 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.406 1.082 . . . . 0.0 112.166 177.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.1 mt -61.33 -33.07 73.0 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.211 -0.931 . . . . 0.0 112.937 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -66.16 -40.04 90.24 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.844 1.202 . . . . 0.0 113.131 171.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -61.53 -40.43 94.63 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 121.708 -0.62 . . . . 0.0 112.151 173.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -18.85 64.55 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 114.417 1.265 . . . . 0.0 114.417 171.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.99 11.93 69.21 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 123.94 0.781 . . . . 0.0 114.864 -176.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.4 mt -89.03 57.52 4.15 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.234 1.814 . . . . 0.0 109.903 178.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -56.8 -39.24 73.77 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.939 1.295 . . . . 0.0 114.056 -170.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -83.33 -27.99 29.36 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.124 0.874 . . . . 0.0 111.582 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -70.74 -33.2 70.57 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.175 0.443 . . . . 0.0 111.925 164.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.31 -49.11 68.14 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.661 0.664 . . . . 0.0 111.803 174.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.3 t -59.05 -37.03 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 117.981 -1.009 . . . . 0.0 111.02 175.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -54.99 -42.14 72.09 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.859 1.209 . . . . 0.0 112.912 174.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 74.3 m -66.46 -37.06 84.3 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 119.091 0.859 . . . . 0.0 112.685 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 47' ' ' ALA . 81.4 m-85 -75.06 -38.27 61.41 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 175.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -64.23 -35.72 81.73 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.26 0.624 . . . . 0.0 110.636 173.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -23.31 66.4 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 173.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.3 mt -60.61 -42.17 96.29 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 120.146 1.339 . . . . 0.0 109.46 168.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.1 mt -82.95 -28.6 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.4 1.48 . . . . 0.0 112.147 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.7 m -58.5 -32.87 69.2 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 120.662 -1.274 . . . . 0.0 111.512 168.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -89.61 -29.09 19.09 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 175.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -136.16 68.85 63.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 124.987 1.315 . . . . 0.0 110.774 -168.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -61.29 -36.8 77.53 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 122.291 1.994 . . . . 0.0 115.552 -163.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -89.37 6.8 38.94 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -174.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -105.24 130.49 23.01 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -158.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.49 -17.31 53.09 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.555 2.17 . . . . 0.0 113.414 168.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.78 2.44 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.613 1.565 . . . . 0.0 114.7 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -116.6 -36.97 1.02 Allowed Glycine 0 CA--C 1.531 1.09 0 O-C-N 121.5 -0.75 . . . . 0.0 112.679 155.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -60.29 -44.05 95.72 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.036 1.418 . . . . 0.0 112.881 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 78.4 p -67.8 -27.36 66.67 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.658 -0.651 . . . . 0.0 112.294 -177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -84.04 -42.24 16.36 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.439 1.495 . . . . 0.0 110.908 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -64.66 -32.12 73.64 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.245 -0.909 . . . . 0.0 112.335 172.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.49 -37.04 85.76 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.125 -0.984 . . . . 0.0 112.633 170.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.2 tpt -66.14 -38.74 88.87 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.856 0.862 . . . . 0.0 111.735 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.405 ' HB2' ' CD2' ' A' ' 27' ' ' TYR . . . -59.8 -42.35 93.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.409 0.684 . . . . 0.0 111.831 174.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.2 -36.68 84.93 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 118.58 -0.724 . . . . 0.0 112.68 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 11.3 pt -68.49 -33.84 62.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 120.312 1.415 . . . . 0.0 112.37 169.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.415 ' HE3' HG12 ' B' ' -1' ' ' VAL . 0.3 OUTLIER -78.79 -12.33 60.02 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 179.245 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 -17.14 38.28 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.917 2.087 . . . . 0.0 111.039 163.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.8 22.09 56.34 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 124.856 1.217 . . . . 0.0 114.308 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -107.73 57.94 0.62 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.891 1.676 . . . . 0.0 110.123 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -56.21 -36.22 68.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.579 1.552 . . . . 0.0 112.497 -175.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.6 m -62.27 -26.73 68.56 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 119.387 0.994 . . . . 0.0 112.625 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -84.09 -28.74 27.33 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.511 -0.743 . . . . 0.0 111.93 172.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.16 -36.43 58.75 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.177 0.991 . . . . 0.0 113.298 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 29.9 pt -68.17 -32.08 54.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 CA-C-N 119.023 0.829 . . . . 0.0 111.996 175.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -61.55 -50.48 72.47 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.22 0.608 . . . . 0.0 110.049 166.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.5 ttm -69.09 -32.41 71.82 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -174.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -70.35 -39.59 74.58 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.827 -1.171 . . . . 0.0 112.034 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -73.07 -28.68 62.45 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.736 1.153 . . . . 0.0 113.394 171.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.73 -32.12 73.51 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.878 -1.139 . . . . 0.0 111.265 166.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.11 -22.7 73.28 Favored Glycine 0 CA--C 1.535 1.32 0 CA-C-O 117.87 -1.516 . . . . 0.0 114.514 173.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 89.6 mt -56.84 -29.71 63.08 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.288 2.044 . . . . 0.0 112.313 170.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -64.7 -1.13 1.71 Allowed 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 126.193 1.797 . . . . 0.0 114.516 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -130.41 37.65 3.83 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.553 1.941 . . . . 0.0 111.482 -174.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 51.0 p -129.73 -14.19 4.1 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 -167.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.6 m -80.12 22.4 0.52 Allowed 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 -163.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.1 p -141.33 161.27 38.3 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 119.659 1.118 . . . . 0.0 111.97 -173.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.9 -24.57 67.9 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 178.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -66.91 -18.22 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.237 1.015 . . . . 0.0 113.068 170.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -126.63 14.89 7.59 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.261 1.424 . . . . 0.0 113.88 -173.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.29 -29.99 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 120.975 -1.078 . . . . 0.0 113.055 177.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.76 -44.94 54.65 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.067 -1.021 . . . . 0.0 110.886 170.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.87 -35.84 53.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 125.275 1.43 . . . . 0.0 112.459 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 21.6 ttp-105 -58.83 -39.72 82.06 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.23 1.012 . . . . 0.0 112.219 176.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 50.5 m -77.7 -39.2 45.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.569 1.148 . . . . 0.0 112.234 172.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -68.59 -16.93 64.02 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -178.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -91.07 -32.09 16.01 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.053 1.297 . . . . 0.0 113.705 163.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -78.55 -42.3 29.68 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 120.402 1.455 . . . . 0.0 113.319 -175.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -34.86 78.74 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.969 1.259 . . . . 0.0 110.814 171.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -67.39 -36.93 82.28 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.681 1.593 . . . . 0.0 111.989 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.0 tp -67.96 -39.38 83.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.716 1.206 . . . . 0.0 112.051 170.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.5 -39.89 94.95 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.265 -0.897 . . . . 0.0 112.383 169.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.9 -29.51 62.1 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 119.981 1.264 . . . . 0.0 112.863 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.47 96.44 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.96 -1.088 . . . . 0.0 111.169 167.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.496 ' HA ' HG12 ' A' ' 91' ' ' VAL . 38.2 mt-30 -69.99 -19.89 63.32 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.216 1.006 . . . . 0.0 112.566 172.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -65.86 -62.8 4.46 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.819 2.152 . . . . 0.0 112.757 168.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -71.56 -27.97 63.53 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -175.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 88' ' ' GLN . 0.9 OUTLIER -71.51 -15.4 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 O-C-N 121.101 -0.999 . . . . 0.0 112.933 171.369 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 74.01 37.42 49.98 Favored Glycine 0 CA--C 1.534 1.233 0 CA-C-N 118.998 0.817 . . . . 0.0 114.539 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.8 m -50.87 -33.66 24.88 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 118.841 1.32 . . . . 0.0 113.948 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.36 146.49 28.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.893 1.277 . . . . 0.0 111.402 165.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -139.04 142.91 38.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.565 1.146 . . . . 0.0 112.195 -173.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.5 mt 60.54 89.94 0.1 OUTLIER Pre-proline 0 N--CA 1.477 0.912 0 C-N-CA 126.486 1.915 . . . . 0.0 111.414 178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -74.18 -7.16 19.46 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.0 2.467 . . . . 0.0 113.429 175.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . 0.258 2.2 t 69.15 43.65 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 125.351 1.461 . . . . 0.0 113.363 174.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.5 p -136.9 152.17 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 129.732 3.213 . . . . 0.0 107.417 171.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -60.91 -40.39 92.96 Favored 'General case' 0 N--CA 1.482 1.157 0 CA-C-N 120.164 1.347 . . . . 0.0 113.892 -170.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.3 t -138.55 137.72 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 C-N-CA 125.715 1.606 . . . . 0.0 110.776 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -160.45 -77.71 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.789 1.636 . . . . 0.0 109.642 175.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -135.22 -47.87 0.71 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.428 1.491 . . . . 0.0 109.202 158.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 11.0 mp 63.01 164.38 0.11 Allowed Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 128.061 2.544 . . . . 0.0 113.268 173.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -66.26 161.73 39.22 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 121.52 1.48 . . . . 0.0 111.441 159.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -55.96 134.0 51.96 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.04 1.336 . . . . 0.0 112.799 -174.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.6 -24.76 2.17 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 125.668 1.604 . . . . 0.0 115.387 178.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -62.51 -17.26 59.31 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.028 1.414 . . . . 0.0 113.903 -170.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -63.11 -31.56 72.73 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 172.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? 38.57 32.83 0.06 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 127.218 2.207 . . . . 0.0 114.543 -175.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 59.0 m . . . . . 0 C--O 1.253 1.263 0 C-N-CA 125.084 1.354 . . . . 0.0 112.185 -169.757 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -163.79 155.79 17.14 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.429 1.491 . . . . 0.0 112.179 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -147.29 -45.15 0.17 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.375 2.27 . . . . 0.0 111.378 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . 0.415 HG12 ' HE3' ' A' ' 50' ' ' LYS . 49.1 t -140.68 147.28 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 125.822 1.649 . . . . 0.0 109.688 -175.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 124.149 0.979 . . . . 0.0 113.089 177.736 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 tpp . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 119.107 -0.473 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 m -57.48 -25.38 59.66 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -173.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 -61.25 -47.99 83.5 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.871 1.669 . . . . 0.0 111.041 173.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.42 -17.37 60.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.045 0.938 . . . . 0.0 113.298 176.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.22 -45.13 57.98 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 120.772 -1.205 . . . . 0.0 111.656 165.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -25.63 60.35 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.446 1.475 . . . . 0.0 113.855 178.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -75.58 -26.57 58.03 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 119.363 0.983 . . . . 0.0 113.274 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -69.33 -39.23 78.32 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.003 -1.061 . . . . 0.0 111.725 170.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -64.0 -39.06 93.27 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 169.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -59.44 -43.03 93.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.853 0.861 . . . . 0.0 111.479 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.23 -56.15 25.77 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 118.783 0.72 . . . . 0.0 112.183 173.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -54.89 -42.97 72.77 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.942 0.897 . . . . 0.0 111.852 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.8 t -68.88 -38.88 79.96 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.951 1.701 . . . . 0.0 113.43 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.4 mt -65.88 -35.36 80.43 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 120.779 -1.201 . . . . 0.0 111.322 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -63.3 -40.67 97.99 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 119.362 0.983 . . . . 0.0 112.269 169.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.06 -33.53 76.0 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 121.344 -0.847 . . . . 0.0 112.618 177.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.02 -30.82 55.96 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.456 1.102 . . . . 0.0 113.399 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 108.78 12.36 20.96 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.433 1.492 . . . . 0.0 115.12 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.77 53.79 2.94 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 126.058 1.743 . . . . 0.0 109.642 174.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -57.61 -36.32 71.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.57 1.148 . . . . 0.0 113.606 -168.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.7 mmt-85 -75.84 -38.37 58.09 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 120.943 -1.098 . . . . 0.0 111.726 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.78 -31.91 71.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.694 0.397 . . . . 0.0 111.632 172.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.16 98.56 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.04 0.936 . . . . 0.0 112.65 171.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.72 -41.27 89.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.735 0.814 . . . . 0.0 111.299 173.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.1 m-70 -59.65 -38.46 81.48 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.226 0.921 . . . . 0.0 112.568 173.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.2 m -66.28 -26.46 67.34 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 117.72 -1.133 . . . . 0.0 113.573 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.93 -37.49 39.64 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 121.022 1.737 . . . . 0.0 112.261 168.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.87 -29.95 71.14 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.097 0.862 . . . . 0.0 112.094 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -66.64 -36.52 82.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 118.472 -0.775 . . . . 0.0 111.896 172.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.0 mt -63.8 -41.79 97.84 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.838 1.199 . . . . 0.0 111.217 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.21 -23.09 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.896 0.879 . . . . 0.0 111.019 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.4 m -78.17 -40.81 36.64 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 121.275 -0.89 . . . . 0.0 111.582 171.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.66 -31.5 24.14 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -129.69 66.39 77.14 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 126.169 1.787 . . . . 0.0 112.02 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -60.01 -26.69 83.11 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 123.297 2.664 . . . . 0.0 116.91 -170.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -106.56 5.86 29.51 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.456 1.503 . . . . 0.0 112.128 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -87.4 137.63 32.4 Favored Pre-proline 0 CA--C 1.538 0.498 0 O-C-N 121.017 -1.052 . . . . 0.0 111.893 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HB2' HG21 ' A' ' 76' ' ' ILE . 57.9 Cg_endo -63.39 -22.78 71.67 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 122.176 1.917 . . . . 0.0 114.039 176.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 6.1 p -57.82 -42.09 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 124.971 1.308 . . . . 0.0 113.702 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -73.65 -40.39 46.37 Favored Glycine 0 N--CA 1.468 0.829 0 O-C-N 120.899 -1.126 . . . . 0.0 112.183 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -64.3 -37.34 87.14 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.239 1.02 . . . . 0.0 111.769 173.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 38.4 m -59.39 -30.22 68.28 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.961 0.904 . . . . 0.0 112.676 172.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . 0.274 6.0 m120 -103.36 -16.07 15.74 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -176.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -65.96 -43.09 88.95 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 119.187 0.903 . . . . 0.0 110.648 155.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.08 -40.35 89.26 Favored 'General case' 0 CA--C 1.547 0.859 0 O-C-N 121.143 -0.973 . . . . 0.0 112.661 170.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.2 tpt -62.61 -44.21 96.88 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.606 0.762 . . . . 0.0 112.324 173.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -46.03 89.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.178 0.991 . . . . 0.0 111.94 175.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.5 mt -59.45 -38.83 81.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.48 0.712 . . . . 0.0 112.349 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.4 pt -77.51 -27.98 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.758 1.163 . . . . 0.0 112.929 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -12.6 61.02 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 171.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 5.9 mt -118.16 -5.94 10.9 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 126.866 2.066 . . . . 0.0 114.957 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.32 45.37 8.13 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 119.264 0.938 . . . . 0.0 115.319 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -118.04 49.57 1.24 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.821 1.649 . . . . 0.0 110.094 169.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.27 -35.05 71.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.474 1.11 . . . . 0.0 112.959 -168.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 91.6 m -65.01 -31.26 72.4 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.625 1.17 . . . . 0.0 112.52 176.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -81.36 -31.31 33.43 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.087 0.555 . . . . 0.0 110.957 175.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.44 -44.95 85.71 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.712 -0.618 . . . . 0.0 111.621 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.9 pt -63.95 -29.69 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.997 0.817 . . . . 0.0 113.072 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -63.82 -49.62 72.13 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.49 0.716 . . . . 0.0 110.81 168.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 30.1 ttm -69.61 -26.2 64.32 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 71.0 m -60.25 -45.65 92.52 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.437 -0.789 . . . . 0.0 111.307 170.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -71.13 -40.57 71.31 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.998 0.919 . . . . 0.0 112.461 176.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -58.91 -34.1 71.31 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.3 -0.875 . . . . 0.0 111.756 171.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -77.81 -20.22 74.04 Favored Glycine 0 CA--C 1.533 1.204 0 O-C-N 120.66 -1.275 . . . . 0.0 115.025 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.18 -35.19 73.13 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.971 1.886 . . . . 0.0 111.17 166.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -72.55 -2.56 20.27 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 115.068 1.507 . . . . 0.0 115.068 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -105.89 -5.12 19.95 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.953 1.301 . . . . 0.0 112.699 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 74.4 p -137.75 0.97 2.27 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 116.073 1.879 . . . . 0.0 116.073 -162.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.4 m -82.04 54.34 2.47 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.613 1.097 . . . . 0.0 111.918 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.6 t -157.94 151.37 23.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.764 1.626 . . . . 0.0 111.867 -175.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -47.96 -31.43 5.26 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.149 1.78 . . . . 0.0 115.312 -177.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -82.83 1.58 38.47 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -178.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -145.64 17.8 1.48 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 126.264 1.826 . . . . 0.0 113.625 -175.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 18.3 m -64.34 -25.7 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 115.643 1.719 . . . . 0.0 115.643 -171.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.96 -20.13 20.27 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.546 1.538 . . . . 0.0 111.859 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.43 HG21 ' HB2' ' A' ' 38' ' ' PRO . 2.4 mm -70.43 -38.22 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 O-C-N 121.285 -0.884 . . . . 0.0 109.685 163.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttt180 -52.96 -43.44 66.38 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.071 0.948 . . . . 0.0 110.66 173.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 19.9 m -57.4 -39.98 77.27 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.613 1.565 . . . . 0.0 113.944 171.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.29 -47.02 82.55 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 120.307 1.412 . . . . 0.0 111.765 169.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -69.12 -32.99 72.77 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 120.037 1.29 . . . . 0.0 113.21 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 35.7 mm-40 -62.17 -50.31 72.36 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 120.374 1.443 . . . . 0.0 110.92 169.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . 0.255 0.0 OUTLIER -71.69 -31.13 66.43 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -173.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -52.37 -43.89 64.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.105 0.866 . . . . 0.0 110.87 165.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.38 -38.59 74.76 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.936 0.895 . . . . 0.0 111.945 -178.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.84 -34.18 77.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.832 1.253 . . . . 0.0 112.339 176.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -93.0 -11.93 31.93 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 174.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -70.35 -54.14 13.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.084 1.311 . . . . 0.0 110.166 165.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -70.07 -22.19 63.08 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.258 0.623 . . . . 0.0 111.161 175.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -66.96 -60.67 5.86 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.316 2.388 . . . . 0.0 114.418 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -73.19 -20.75 60.82 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 118.568 1.184 . . . . 0.0 113.386 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.4 p -77.34 -13.6 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 171.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -161.88 97.54 0.15 Allowed Glycine 0 CA--C 1.533 1.177 0 CA-C-N 119.09 0.859 . . . . 0.0 114.57 171.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.2 m -81.31 77.22 8.21 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.593 1.957 . . . . 0.0 111.957 -176.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -154.84 130.37 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 126.551 1.94 . . . . 0.0 109.939 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -129.92 -14.25 4.0 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.445 1.498 . . . . 0.0 114.669 -174.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 11.5 mt -92.82 109.84 41.66 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 124.819 1.248 . . . . 0.0 109.024 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -82.38 -4.99 11.82 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.961 3.107 . . . . 0.0 114.077 -178.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 t 56.46 51.55 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.629 1.572 . . . . 0.0 112.372 175.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 19.4 m -139.65 163.12 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 127.646 2.378 . . . . 0.0 109.481 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -81.32 -22.5 38.48 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -167.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.6 t -142.96 121.35 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 123.875 0.87 . . . . 0.0 110.874 172.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -162.58 -143.79 0.08 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.747 2.019 . . . . 0.0 108.933 173.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -76.01 -53.95 7.59 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 119.906 -1.746 . . . . 0.0 109.812 169.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.1 mt 66.53 162.29 0.13 Allowed Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.401 1.88 . . . . 0.0 114.502 169.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -60.96 167.55 8.67 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.344 2.696 . . . . 0.0 112.251 162.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.18 -25.89 58.61 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -170.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -115.7 97.23 0.78 Allowed Glycine 0 CA--C 1.531 1.037 0 C-N-CA 125.908 1.718 . . . . 0.0 110.984 172.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -153.52 -166.35 2.39 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.462 1.105 . . . . 0.0 111.568 -173.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -52.98 133.15 38.37 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.831 1.252 . . . . 0.0 113.301 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -161.09 143.37 12.33 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.831 1.252 . . . . 0.0 111.17 168.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 32.1 m . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.225 1.41 . . . . 0.0 111.855 171.641 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' -4' ' ' MET . . . . . . . . . . . . . 8.2 tpt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' -3' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -147.77 151.93 36.87 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.771 1.628 . . . . 0.0 111.16 170.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -2' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -103.64 152.63 21.55 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -1' ' ' VAL . . . . . . . . . . . . . 10.5 p -128.72 163.51 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 126.891 2.076 . . . . 0.0 111.003 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 0' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 C--O 1.251 1.182 0 C-N-CA 125.231 1.412 . . . . 0.0 113.353 179.694 . . . . . . . . 0 0 . 1 stop_ save_