data_2rv1_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 2rv1 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 119.041 -0.504 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -116.37 138.16 51.56 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.479 1.111 . . . . 0.0 112.567 176.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -57.07 139.53 78.9 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 126.006 1.722 . . . . 0.0 112.611 -173.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -72.3 -2.72 12.11 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.565 2.177 . . . . 0.0 114.01 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -126.38 -28.24 3.09 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.8 p -139.6 -171.39 3.13 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -175.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -82.27 -3.45 55.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.432 1.493 . . . . 0.0 114.038 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -82.66 154.97 24.63 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -171.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.475 0.804 0 C-N-CA 125.602 1.561 . . . . 0.0 114.253 -176.645 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.0 tp . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.3 mm100 -64.28 -43.85 93.51 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.676 -0.64 . . . . 0.0 110.602 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -64.45 -41.7 96.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.917 0.887 . . . . 0.0 112.255 173.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -61.82 -37.47 84.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.638 0.775 . . . . 0.0 112.549 176.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.5 mt -73.68 -47.98 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.148 -0.97 . . . . 0.0 111.548 175.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.4 m0 -55.63 -27.44 49.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -39.09 73.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.08 0.952 . . . . 0.0 112.862 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -67.35 -33.91 76.21 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.168 171.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -73.14 -0.98 15.71 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.941 1.297 . . . . 0.0 113.938 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.391 0 C-N-CA 124.777 1.179 . . . . 0.0 115.477 173.378 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.186 -0.435 . . . . 0.0 110.365 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -115.02 137.5 51.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.816 1.246 . . . . 0.0 111.741 174.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.03 138.15 83.76 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.801 1.24 . . . . 0.0 112.324 -176.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -71.35 -3.92 13.93 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.016 2.477 . . . . 0.0 114.113 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -126.61 -28.74 2.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.5 p -133.81 179.63 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -177.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.25 -4.2 54.81 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -83.86 158.56 21.6 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 . . . . . 0 N--CA 1.468 0.46 0 C-N-CA 125.917 1.687 . . . . 0.0 113.166 -174.928 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp . . . . . 0 CA--C 1.534 0.356 0 N-CA-C 111.1 0.037 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -61.26 -41.21 96.52 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.596 -0.69 . . . . 0.0 111.224 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.28 -41.41 85.49 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.515 0.726 . . . . 0.0 112.213 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -59.66 -37.36 78.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.693 0.797 . . . . 0.0 112.429 174.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -73.52 -49.46 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 O-C-N 121.327 -0.858 . . . . 0.0 111.59 176.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -50.88 -32.69 21.29 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.743 0.817 . . . . 0.0 112.531 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.47 -34.34 74.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.018 0.927 . . . . 0.0 113.274 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.3 -29.8 67.73 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.452 -0.78 . . . . 0.0 112.113 171.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.67 1.43 17.05 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.607 1.163 . . . . 0.0 113.304 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.448 0 C-N-CA 125.644 1.593 . . . . 0.0 115.382 177.855 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 119.014 -0.517 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -117.5 136.3 53.33 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.844 1.258 . . . . 0.0 112.032 176.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.26 140.83 78.35 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.046 1.738 . . . . 0.0 113.224 -170.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.6 -3.52 13.63 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.687 2.258 . . . . 0.0 114.203 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -125.55 -28.06 3.35 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.9 p -138.06 -172.94 3.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.06 -2.29 56.42 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -78.96 153.97 29.95 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -173.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 125.431 1.492 . . . . 0.0 114.191 -176.512 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.8 tp . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -57.82 -46.6 84.46 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.177 0.591 . . . . 0.0 111.109 176.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -62.73 -42.36 99.62 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.436 0.694 . . . . 0.0 112.614 174.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -62.42 -36.98 84.06 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 112.697 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.4 mt -73.8 -48.71 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 O-C-N 121.053 -1.029 . . . . 0.0 111.401 176.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -54.08 -30.29 47.68 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.397 0.679 . . . . 0.0 112.217 174.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -37.96 76.24 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.18 0.992 . . . . 0.0 113.109 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -67.01 -32.96 74.54 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.942 0.792 . . . . 0.0 112.141 170.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -73.96 0.47 13.41 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.428 1.091 . . . . 0.0 113.821 169.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.409 0 C-N-CA 124.978 1.275 . . . . 0.0 115.482 175.013 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.588 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -105.66 137.17 43.96 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.28 1.432 . . . . 0.0 112.484 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -55.63 134.69 71.53 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.234 1.414 . . . . 0.0 112.422 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.44 -4.08 14.6 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.1 2.533 . . . . 0.0 114.108 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -120.91 -30.2 4.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . 0.25 16.1 p -125.69 -132.34 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.274 1.03 . . . . 0.0 112.651 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -139.14 11.23 2.59 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.328 1.851 . . . . 0.0 112.98 -175.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -81.99 149.5 28.11 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.139 -0.976 . . . . 0.0 112.301 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.47 0.563 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -176.871 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 tp . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -57.03 -43.81 82.28 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.653 -0.654 . . . . 0.0 111.243 172.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -63.15 -43.78 97.33 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.032 0.833 . . . . 0.0 112.322 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -61.08 -38.57 86.74 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.606 0.763 . . . . 0.0 112.589 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.8 mt -74.39 -48.91 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.207 -0.933 . . . . 0.0 111.782 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.9 m0 -52.9 -30.94 37.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.599 0.759 . . . . 0.0 112.555 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.57 -37.28 76.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.113 0.965 . . . . 0.0 113.064 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -68.15 -31.6 71.28 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.502 -0.749 . . . . 0.0 112.13 171.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -74.72 0.36 15.52 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.317 1.047 . . . . 0.0 113.672 169.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 C-N-CA 125.217 1.389 . . . . 0.0 115.375 175.572 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 119.107 -0.473 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -116.59 138.26 51.56 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.592 1.157 . . . . 0.0 112.623 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.97 139.05 78.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.787 1.635 . . . . 0.0 112.556 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -71.66 -3.49 13.2 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.811 2.34 . . . . 0.0 113.702 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -126.83 -28.16 2.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.25 -172.68 3.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -176.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.29 -3.72 55.81 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.229 1.412 . . . . 0.0 114.054 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -82.99 155.4 23.98 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -171.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 . . . . . 0 N--CA 1.472 0.649 0 C-N-CA 125.619 1.568 . . . . 0.0 113.905 -176.577 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 tp . . . . . 0 N--CA 1.468 0.474 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -55.61 -45.09 77.56 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 118.324 0.511 . . . . 0.0 111.266 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -66.77 -43.21 84.63 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.718 1.207 . . . . 0.0 112.053 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -60.34 -38.46 83.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.681 1.192 . . . . 0.0 112.66 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.4 mt -74.68 -48.52 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 121.075 -1.015 . . . . 0.0 111.576 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -53.49 -29.48 36.35 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.155 0.582 . . . . 0.0 112.433 173.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -39.95 70.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.906 0.882 . . . . 0.0 112.945 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -65.48 -34.09 77.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.909 0.777 . . . . 0.0 112.177 170.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.26 -5.34 41.5 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.438 1.095 . . . . 0.0 113.882 172.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.393 0 C-N-CA 124.486 1.041 . . . . 0.0 114.933 176.759 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -114.97 139.12 50.09 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.583 1.153 . . . . 0.0 111.775 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.02 137.29 80.09 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.96 1.304 . . . . 0.0 112.204 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.06 -4.06 13.47 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 122.958 2.439 . . . . 0.0 114.138 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -127.54 -27.55 2.86 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.6 p -137.7 -171.08 2.91 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -85.02 -5.87 59.34 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.846 1.258 . . . . 0.0 114.308 -173.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -75.04 152.64 38.66 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 . . . . . 0 N--CA 1.469 0.482 0 C-N-CA 125.743 1.617 . . . . 0.0 113.154 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 110.548 -0.167 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -60.33 -43.65 96.22 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.79 -0.569 . . . . 0.0 110.779 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.5 ttp85 -58.9 -46.36 88.06 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.084 1.354 . . . . 0.0 112.845 171.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -60.49 -36.94 79.51 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.943 0.897 . . . . 0.0 112.451 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.2 mt -75.08 -49.06 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.089 0.956 . . . . 0.0 111.831 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -54.58 -28.48 46.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.862 0.865 . . . . 0.0 112.55 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.17 -37.55 75.22 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.821 0.848 . . . . 0.0 112.964 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -68.68 -33.83 74.63 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.452 -0.78 . . . . 0.0 112.138 171.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.0 -3.58 27.0 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.321 0 C-N-CA 124.766 1.175 . . . . 0.0 115.361 175.155 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.0 tmm? . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -111.98 131.1 55.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.892 1.277 . . . . 0.0 112.154 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.0 t -53.95 139.53 53.0 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.335 1.454 . . . . 0.0 112.87 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -73.32 -2.68 12.45 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.689 2.259 . . . . 0.0 114.036 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -124.86 -27.85 3.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.4 p -138.79 -174.9 3.96 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -83.09 -1.45 52.83 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.081 1.352 . . . . 0.0 114.545 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.26 146.36 43.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.396 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.1 tp . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -61.75 -42.71 99.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.134 0.573 . . . . 0.0 110.906 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.4 mtm180 -66.92 -41.56 86.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.909 0.884 . . . . 0.0 112.204 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -63.97 -38.04 89.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 112.678 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.1 mt -73.28 -48.09 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.004 -1.06 . . . . 0.0 111.309 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 15.4 m0 -51.5 -31.43 23.8 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.277 0.631 . . . . 0.0 112.608 172.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.31 -38.92 71.7 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.502 0.721 . . . . 0.0 112.86 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.7 -33.34 75.41 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.57 -0.706 . . . . 0.0 112.279 170.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -73.89 -2.58 24.44 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.546 1.138 . . . . 0.0 113.781 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.51 0 C-N-CA 124.916 1.246 . . . . 0.0 115.149 176.209 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.521 0 CA-C-O 119.447 -0.311 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -115.32 138.13 51.3 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.714 1.205 . . . . 0.0 112.288 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 40.7 t -57.33 137.5 81.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.237 1.415 . . . . 0.0 112.522 -173.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.85 -4.46 14.12 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 122.987 2.458 . . . . 0.0 114.061 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -128.56 -26.84 2.69 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -135.45 -174.44 3.63 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.26 -4.46 57.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.884 1.273 . . . . 0.0 113.961 -174.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -81.98 153.56 26.17 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 N--CA 1.473 0.683 0 C-N-CA 125.591 1.557 . . . . 0.0 114.022 -177.37 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 49.3 tp . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.62 -44.69 93.35 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.556 -0.715 . . . . 0.0 111.462 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -69.13 -32.54 71.99 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.29 -37.54 87.65 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.974 0.806 . . . . 0.0 111.79 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.91 -49.43 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.353 -0.842 . . . . 0.0 111.811 176.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.5 m0 -54.31 -29.4 47.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.328 0.651 . . . . 0.0 112.644 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.39 -37.98 77.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.033 0.933 . . . . 0.0 113.047 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -67.88 -32.55 73.11 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.414 -0.804 . . . . 0.0 112.165 171.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.93 -0.52 16.38 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.361 1.064 . . . . 0.0 113.712 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.464 0 C-N-CA 125.0 1.286 . . . . 0.0 115.377 175.205 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -113.19 141.03 47.43 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.229 1.012 . . . . 0.0 111.355 171.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 44.4 t -55.05 139.57 63.72 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.552 1.541 . . . . 0.0 112.573 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -71.21 -4.88 15.81 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.046 2.497 . . . . 0.0 114.03 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -126.4 -25.84 3.41 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.0 p -135.48 -166.97 1.93 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.241 1.016 . . . . 0.0 113.302 177.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -104.91 16.25 26.29 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.209 1.403 . . . . 0.0 113.461 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -78.55 146.35 34.31 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.851 0.861 . . . . 0.0 111.973 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 124.794 1.238 . . . . 0.0 113.955 -176.163 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 47.0 tp . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 110.8 -0.074 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.92 -34.51 77.61 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.174 -0.954 . . . . 0.0 112.125 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -64.65 -47.21 79.33 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.916 1.287 . . . . 0.0 112.098 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -57.84 -37.16 73.37 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.414 0.686 . . . . 0.0 112.21 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 80.0 mt -73.76 -48.82 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.012 0.925 . . . . 0.0 112.061 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.3 m0 -53.83 -28.16 33.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.608 0.763 . . . . 0.0 112.846 174.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.87 74.71 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.505 0.722 . . . . 0.0 112.841 175.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -71.32 -34.02 70.2 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.454 0.702 . . . . 0.0 112.216 171.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.73 -5.74 36.16 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 170.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.223 0 C-N-CA 124.618 1.104 . . . . 0.0 114.935 175.214 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.69 132.7 54.43 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.302 1.041 . . . . 0.0 112.169 172.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -55.8 137.27 71.81 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.385 1.074 . . . . 0.0 111.729 -178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -72.16 -2.84 12.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.792 2.328 . . . . 0.0 114.217 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -127.22 -25.83 3.18 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.3 p -136.06 179.65 6.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.38 -3.28 49.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -173.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -80.15 151.23 29.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -171.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.585 1.554 . . . . 0.0 115.01 -175.023 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 119.778 -0.154 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -58.23 -43.77 87.94 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.857 -0.527 . . . . 0.0 111.092 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -66.4 -39.57 89.11 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.142 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -61.93 -37.13 83.54 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.315 1.046 . . . . 0.0 112.317 173.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.9 mt -72.1 -47.6 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 O-C-N 121.04 -1.037 . . . . 0.0 111.36 174.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -56.45 -25.81 51.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.533 0.733 . . . . 0.0 112.67 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.27 -37.88 66.12 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.122 -0.986 . . . . 0.0 112.775 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -67.96 -33.89 75.52 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.548 -0.72 . . . . 0.0 112.037 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -72.52 -4.72 32.28 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.98 1.312 . . . . 0.0 114.037 170.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.386 0 C-N-CA 124.413 1.006 . . . . 0.0 114.936 175.599 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 118.605 -0.712 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -113.97 131.56 56.29 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.024 1.33 . . . . 0.0 112.583 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -55.79 140.29 68.19 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.351 1.46 . . . . 0.0 112.861 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -74.36 -3.65 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.828 2.352 . . . . 0.0 114.098 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -124.99 -28.69 3.43 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -135.89 -177.22 4.59 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.242 1.017 . . . . 0.0 113.693 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -81.74 -0.67 44.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.997 1.319 . . . . 0.0 114.446 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -75.08 149.92 39.0 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 125.361 1.464 . . . . 0.0 114.595 -176.306 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.5 tp . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -60.94 -32.39 71.9 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.269 -0.894 . . . . 0.0 112.123 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -68.34 -41.88 80.11 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.189 0.995 . . . . 0.0 112.556 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -64.09 -34.87 79.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.745 0.818 . . . . 0.0 112.032 174.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.1 mt -72.62 -48.66 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 121.221 -0.924 . . . . 0.0 111.638 175.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -53.75 -28.41 34.36 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 112.852 173.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.46 -37.84 74.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.484 0.714 . . . . 0.0 112.681 175.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -69.8 -34.05 73.19 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.438 0.695 . . . . 0.0 112.267 171.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -72.5 -4.77 32.47 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.407 0 C-N-CA 124.595 1.093 . . . . 0.0 115.063 175.065 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -113.37 135.24 54.08 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.793 1.637 . . . . 0.0 111.416 176.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.7 t -56.68 141.1 74.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.571 1.548 . . . . 0.0 113.032 -169.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -73.04 -3.32 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.517 2.145 . . . . 0.0 113.94 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -126.28 -25.71 3.46 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.2 p -138.5 -177.01 4.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.458 1.103 . . . . 0.0 113.519 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -81.27 -6.14 58.55 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -81.7 151.53 27.48 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 N--CA 1.471 0.599 0 C-N-CA 125.299 1.44 . . . . 0.0 113.788 -179.129 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 50.7 tp . . . . . 0 CA--C 1.538 0.489 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -58.4 -45.55 88.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.845 0.858 . . . . 0.0 111.469 -178.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -68.64 -31.65 70.94 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -68.66 -37.18 79.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.595 0.758 . . . . 0.0 112.555 173.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -72.36 -47.09 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 O-C-N 121.021 -1.049 . . . . 0.0 111.221 175.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -52.7 -30.31 31.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.377 0.671 . . . . 0.0 112.655 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.99 68.17 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 176.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -65.76 -34.08 77.35 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.873 0.76 . . . . 0.0 112.079 170.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -73.73 -0.39 15.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.929 1.292 . . . . 0.0 113.895 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.384 0 C-N-CA 125.083 1.325 . . . . 0.0 115.368 174.991 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.814 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -96.07 129.07 43.45 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.39 0.995 . . . . 0.0 111.473 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.7 t -52.8 137.33 44.7 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.947 0.899 . . . . 0.0 111.744 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -70.56 -2.91 11.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.915 2.41 . . . . 0.0 114.226 -178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -126.62 -25.17 3.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.9 p -140.14 -179.3 5.9 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.83 1.37 50.05 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -173.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -76.83 139.85 40.46 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.248 -0.908 . . . . 0.0 113.149 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 . . . . . 0 N--CA 1.468 0.451 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.426 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 120.589 0.233 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -61.02 -43.87 98.25 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 111.537 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -62.01 -33.84 75.09 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.941 0.896 . . . . 0.0 113.357 176.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -73.2 -36.67 66.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.152 0.981 . . . . 0.0 111.962 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.64 -48.46 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 121.283 -0.885 . . . . 0.0 111.553 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -54.39 -27.78 38.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.924 0.889 . . . . 0.0 112.644 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.39 -39.5 67.94 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 174.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.63 -34.47 77.94 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.701 0.682 . . . . 0.0 112.092 171.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.11 -7.28 51.98 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.388 1.075 . . . . 0.0 113.748 172.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 C-N-CA 124.536 1.065 . . . . 0.0 114.847 177.261 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? . . . . . 0 CA--C 1.537 0.481 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.717 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -108.93 131.72 54.77 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.509 1.124 . . . . 0.0 111.952 171.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.1 t -54.51 138.38 60.27 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.519 1.127 . . . . 0.0 112.011 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.33 -2.77 12.21 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.913 2.409 . . . . 0.0 114.151 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -124.86 -28.0 3.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.1 -179.47 5.8 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -87.95 7.92 28.77 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -78.24 141.62 38.45 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.127 -0.983 . . . . 0.0 112.829 175.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 . . . . . 0 CA--C 1.536 0.412 0 C-N-CA 125.468 1.507 . . . . 0.0 114.068 179.38 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -65.31 -43.63 90.45 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.64 -0.663 . . . . 0.0 111.279 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.4 mtm-85 -61.16 -43.51 98.77 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 118.807 0.73 . . . . 0.0 112.158 171.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -60.31 -37.6 81.09 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.343 0.657 . . . . 0.0 112.372 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.1 mt -74.4 -49.3 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.033 0.933 . . . . 0.0 111.786 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -54.01 -30.14 46.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 112.388 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.8 78.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.314 1.045 . . . . 0.0 113.134 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -67.88 -32.0 72.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.943 0.792 . . . . 0.0 112.075 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.5 0.76 13.71 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.327 1.051 . . . . 0.0 113.705 169.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.348 0 C-N-CA 125.119 1.342 . . . . 0.0 115.467 175.282 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 CA--C 1.54 0.587 0 CA-C-O 118.597 -0.715 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -98.51 128.55 44.9 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.513 1.051 . . . . 0.0 111.917 175.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.4 t -53.84 139.51 51.95 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 124.483 1.113 . . . . 0.0 112.24 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -72.67 -2.42 11.83 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 122.732 2.288 . . . . 0.0 114.214 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -125.37 -26.48 3.6 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.8 p -138.77 177.36 7.94 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -83.6 0.88 44.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -174.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -80.47 145.28 31.98 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.255 -0.903 . . . . 0.0 113.285 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 125.149 1.38 . . . . 0.0 114.6 -178.478 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.7 tp . . . . . 0 CA--C 1.537 0.444 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -59.33 -46.1 89.54 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.908 -0.495 . . . . 0.0 111.784 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.0 mtm-85 -64.31 -41.08 97.0 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.234 0.614 . . . . 0.0 112.237 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -62.24 -37.75 86.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.716 0.806 . . . . 0.0 112.61 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.4 mt -73.39 -48.46 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 O-C-N 121.098 -1.001 . . . . 0.0 111.596 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 30.2 m0 -54.25 -28.89 44.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.531 0.732 . . . . 0.0 112.374 174.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.22 -39.3 71.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.813 0.845 . . . . 0.0 113.03 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -66.1 -34.41 77.99 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.444 -0.785 . . . . 0.0 112.085 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.67 -4.42 34.24 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 171.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.482 0 C-N-CA 124.648 1.118 . . . . 0.0 115.057 176.383 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 118.92 -0.562 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -95.99 127.83 42.35 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.363 0.983 . . . . 0.0 111.752 174.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.3 t -51.96 138.19 35.03 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.37 1.068 . . . . 0.0 111.912 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -73.03 -1.35 10.39 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.405 2.07 . . . . 0.0 114.065 -178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -125.77 -23.96 3.91 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.887 1.275 . . . . 0.0 114.342 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -142.17 -177.27 5.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -85.51 3.92 38.19 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -177.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -79.66 141.68 36.24 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.176 -0.952 . . . . 0.0 113.002 -178.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -178.263 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.9 tp . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 119.907 -0.092 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -61.0 -41.54 96.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.525 0.73 . . . . 0.0 111.376 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -62.27 -42.89 99.73 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.085 0.954 . . . . 0.0 112.328 172.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -65.13 -36.02 82.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.281 1.032 . . . . 0.0 112.713 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.1 mt -71.8 -47.07 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 O-C-N 120.814 -1.179 . . . . 0.0 111.625 175.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.4 m0 -54.56 -27.8 41.35 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.555 0.742 . . . . 0.0 112.689 171.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.91 -38.82 64.21 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.487 -0.758 . . . . 0.0 112.813 175.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -64.88 -37.17 86.74 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 118.822 0.737 . . . . 0.0 112.008 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -74.5 -4.25 35.67 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 114.278 173.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.479 0 C-N-CA 124.37 0.985 . . . . 0.0 114.725 175.981 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 119.384 -0.341 . . . . 0.0 110.978 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -114.28 137.3 51.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.547 1.539 . . . . 0.0 111.29 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -57.13 138.73 79.88 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 125.765 1.626 . . . . 0.0 112.383 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.37 -2.89 12.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 122.493 2.128 . . . . 0.0 113.83 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -126.43 -26.52 3.29 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.4 p -138.57 -171.69 3.12 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -79.04 -14.91 58.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.111 1.364 . . . . 0.0 113.87 -176.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -73.88 155.84 38.31 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 125.681 1.592 . . . . 0.0 113.916 -178.099 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -60.79 -43.44 98.1 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.611 -0.681 . . . . 0.0 111.804 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -69.97 -32.21 70.31 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -66.37 -37.37 85.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.767 0.827 . . . . 0.0 111.992 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.25 -47.31 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 O-C-N 121.1 -1.0 . . . . 0.0 111.552 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -54.21 -27.78 36.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.609 0.764 . . . . 0.0 112.902 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.29 -38.03 68.85 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.556 -0.715 . . . . 0.0 112.795 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -67.47 -35.22 78.75 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.591 -0.693 . . . . 0.0 112.075 171.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -73.84 -3.35 28.17 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.82 1.248 . . . . 0.0 114.131 171.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.378 0 C-N-CA 124.487 1.042 . . . . 0.0 114.915 174.735 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.0 tttt -112.91 140.22 47.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.364 1.066 . . . . 0.0 111.341 170.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 37.4 t -58.31 137.69 84.98 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.735 1.214 . . . . 0.0 111.578 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -72.28 -3.37 13.21 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 122.999 2.466 . . . . 0.0 114.199 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -126.42 -27.33 3.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.2 p -135.57 -179.3 5.56 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -78.25 -2.41 37.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.866 1.267 . . . . 0.0 114.025 -175.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -83.77 154.11 23.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -170.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 . . . . . 0 N--CA 1.472 0.648 0 C-N-CA 126.026 1.73 . . . . 0.0 113.113 -178.735 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -56.21 -40.78 74.58 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.865 -0.522 . . . . 0.0 111.98 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -66.19 -43.68 86.15 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.108 0.963 . . . . 0.0 111.411 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.77 -36.98 82.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.032 0.933 . . . . 0.0 112.32 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.7 mt -75.18 -49.39 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 O-C-N 121.313 -0.867 . . . . 0.0 111.783 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -55.5 -27.65 49.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.325 0.65 . . . . 0.0 112.478 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.17 73.16 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.717 0.807 . . . . 0.0 112.923 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.77 -33.69 76.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.943 0.792 . . . . 0.0 112.173 171.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.18 -3.28 28.82 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.518 0 C-N-CA 124.694 1.14 . . . . 0.0 115.104 175.482 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -109.91 130.56 55.51 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.938 1.295 . . . . 0.0 112.717 174.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -54.97 140.06 62.07 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.336 1.455 . . . . 0.0 112.599 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -75.34 -3.53 14.02 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.865 2.377 . . . . 0.0 114.135 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -123.84 -29.37 3.69 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.3 p -134.13 -178.47 5.05 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.47 -16.77 59.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.497 1.119 . . . . 0.0 113.915 -175.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.55 150.79 45.73 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -168.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 . . . . . 0 N--CA 1.47 0.536 0 C-N-CA 125.609 1.564 . . . . 0.0 115.189 -176.741 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.0 tp . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 120.69 0.281 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.32 -29.28 68.76 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.403 -0.81 . . . . 0.0 112.379 -178.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -56.36 -45.63 80.39 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.172 1.389 . . . . 0.0 112.446 171.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -74.73 -32.47 62.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.066 1.347 . . . . 0.0 112.343 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.6 mt -72.13 -47.76 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.253 -0.905 . . . . 0.0 111.42 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -52.66 -29.08 24.39 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 112.94 172.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.41 73.03 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.52 0.728 . . . . 0.0 112.556 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -70.69 -32.91 70.32 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.582 0.753 . . . . 0.0 112.401 171.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.3 -3.44 23.79 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.32 0 C-N-CA 124.759 1.171 . . . . 0.0 115.317 174.207 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 119.754 -0.165 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -116.98 139.69 50.36 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.82 1.248 . . . . 0.0 111.504 172.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 41.9 t -56.96 137.35 79.67 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.874 1.27 . . . . 0.0 111.993 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -69.83 -3.68 12.54 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.086 2.524 . . . . 0.0 114.045 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.48 -28.9 2.73 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.7 p -136.75 -173.72 3.51 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -82.79 -5.07 58.76 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.807 1.243 . . . . 0.0 114.272 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -78.96 150.87 31.92 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -174.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 . . . . . 0 N--CA 1.469 0.522 0 C-N-CA 125.96 1.704 . . . . 0.0 113.157 179.796 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.7 tp . . . . . 0 N--CA 1.468 0.458 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -60.94 -41.01 95.45 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.8 . . . . 0.0 111.532 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -58.99 -50.8 72.7 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.126 0.97 . . . . 0.0 112.011 169.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -58.12 -37.51 74.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.389 1.076 . . . . 0.0 112.584 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.8 mt -74.4 -50.0 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 124.083 0.953 . . . . 0.0 111.796 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.7 m0 -51.55 -32.75 29.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.231 0.612 . . . . 0.0 112.598 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.17 84.83 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.241 1.017 . . . . 0.0 112.918 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -71.74 -29.54 64.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.503 0.721 . . . . 0.0 112.631 171.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.04 -4.03 39.09 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 173.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.316 0 O-C-N 121.241 -0.912 . . . . 0.0 113.74 178.053 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m -64.81 -22.21 66.94 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.9 p -81.52 -14.83 56.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.642 1.577 . . . . 0.0 114.235 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.89 146.33 4.58 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.41 1.481 . . . . 0.0 112.691 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.0 69.92 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -171.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.1 p -107.87 -0.83 21.27 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.033 1.733 . . . . 0.0 114.209 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.02 -136.14 48.64 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.206 0.908 . . . . 0.0 113.064 -175.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 52.35 43.55 30.72 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.469 1.908 . . . . 0.0 114.346 172.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.14 165.62 19.98 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.085 0.954 . . . . 0.0 112.558 172.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.46 152.55 36.11 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.537 0.735 . . . . 0.0 110.276 171.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -116.37 138.16 51.56 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.479 1.111 . . . . 0.0 112.567 176.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -57.07 139.53 78.9 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 126.006 1.722 . . . . 0.0 112.611 -173.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -72.3 -2.72 12.11 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.565 2.177 . . . . 0.0 114.01 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -126.38 -28.24 3.09 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.8 p -139.6 -171.39 3.13 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -175.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -82.27 -3.45 55.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.432 1.493 . . . . 0.0 114.038 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -82.66 154.97 24.63 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -171.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -119.76 150.11 40.93 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.602 1.561 . . . . 0.0 114.253 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -141.45 167.73 21.47 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.251 1.42 . . . . 0.0 112.239 170.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.45 140.92 58.65 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.548 -0.72 . . . . 0.0 109.664 168.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -56.96 -20.15 22.11 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -169.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -124.89 16.77 8.61 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.996 1.718 . . . . 0.0 113.016 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -70.9 134.56 23.7 Favored Glycine 0 CA--C 1.535 1.306 0 O-C-N 120.94 -1.1 . . . . 0.0 113.102 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 t -71.47 -31.11 66.76 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 121.847 -0.796 . . . . 0.0 112.864 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -62.48 -24.64 67.57 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.308 1.043 . . . . 0.0 113.241 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.0 tp -60.2 -38.12 82.32 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.863 0.865 . . . . 0.0 112.032 172.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.3 mm100 -64.28 -43.85 93.51 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.676 -0.64 . . . . 0.0 110.602 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -64.45 -41.7 96.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.917 0.887 . . . . 0.0 112.255 173.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -61.82 -37.47 84.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.638 0.775 . . . . 0.0 112.549 176.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.5 mt -73.68 -47.98 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.148 -0.97 . . . . 0.0 111.548 175.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.4 m0 -55.63 -27.44 49.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -39.09 73.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.08 0.952 . . . . 0.0 112.862 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -67.35 -33.91 76.21 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.168 171.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -73.14 -0.98 15.71 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.941 1.297 . . . . 0.0 113.938 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.03 15.56 80.36 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.777 1.179 . . . . 0.0 115.477 173.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.9 t -71.08 135.24 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-N 118.761 1.28 . . . . 0.0 110.139 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.019 1.328 . . . . 0.0 113.065 -177.94 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.8 m -136.02 151.26 49.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.274 1.43 . . . . 0.0 111.992 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.5 m -70.01 144.88 52.13 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.383 1.073 . . . . 0.0 112.855 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 161.81 -169.43 37.24 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.624 1.107 . . . . 0.0 113.742 178.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 m -69.92 -3.16 14.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.138 1.375 . . . . 0.0 114.491 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.8 p -74.93 -5.97 46.69 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.532 1.933 . . . . 0.0 114.62 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -54.95 124.51 32.7 Favored Glycine 0 CA--C 1.537 1.439 0 C-N-CA 124.336 0.97 . . . . 0.0 113.085 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 55.88 18.2 2.89 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.944 2.097 . . . . 0.0 115.901 -174.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.41 176.94 5.01 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.043 1.337 . . . . 0.0 111.837 169.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.67 152.36 26.61 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.162 1.385 . . . . 0.0 110.365 169.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -115.02 137.5 51.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.816 1.246 . . . . 0.0 111.741 174.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.03 138.15 83.76 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.801 1.24 . . . . 0.0 112.324 -176.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -71.35 -3.92 13.93 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.016 2.477 . . . . 0.0 114.113 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -126.61 -28.74 2.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.5 p -133.81 179.63 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -177.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.25 -4.2 54.81 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -83.86 158.56 21.6 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -119.21 153.35 35.1 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.917 1.687 . . . . 0.0 113.166 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -128.91 144.55 51.21 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.937 1.295 . . . . 0.0 109.776 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.0 ptm -84.48 -10.47 57.45 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -135.77 162.13 33.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.061 2.144 . . . . 0.0 110.82 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -105.27 20.14 19.38 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.912 1.685 . . . . 0.0 113.894 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -71.95 -177.09 28.13 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.957 1.265 . . . . 0.0 114.988 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 m -59.25 -25.45 64.07 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -172.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -62.12 -36.57 82.17 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.288 -0.883 . . . . 0.0 112.441 175.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -69.17 -40.12 78.34 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.301 0.64 . . . . 0.0 111.1 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -61.26 -41.21 96.52 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.596 -0.69 . . . . 0.0 111.224 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.28 -41.41 85.49 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.515 0.726 . . . . 0.0 112.213 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -59.66 -37.36 78.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.693 0.797 . . . . 0.0 112.429 174.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -73.52 -49.46 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 O-C-N 121.327 -0.858 . . . . 0.0 111.59 176.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -50.88 -32.69 21.29 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.743 0.817 . . . . 0.0 112.531 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.47 -34.34 74.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.018 0.927 . . . . 0.0 113.274 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.3 -29.8 67.73 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.452 -0.78 . . . . 0.0 112.113 171.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.67 1.43 17.05 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.607 1.163 . . . . 0.0 113.304 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.11 4.16 90.33 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.644 1.593 . . . . 0.0 115.382 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 40.6 t -80.64 140.39 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.282 1.433 . . . . 0.0 110.262 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? . . . . . 0 C--O 1.25 1.123 0 C-N-CA 125.093 1.357 . . . . 0.0 112.262 -172.88 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 110.854 -0.898 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 p -79.8 143.9 34.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.505 1.122 . . . . 0.0 113.609 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -66.25 168.43 8.68 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.532 1.933 . . . . 0.0 114.034 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.15 26.63 73.37 Favored Glycine 0 CA--C 1.535 1.34 0 O-C-N 121.587 -0.696 . . . . 0.0 114.195 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.4 m 58.59 26.66 14.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.718 1.607 . . . . 0.0 114.622 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.8 m -71.52 -35.62 70.78 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.28 -0.887 . . . . 0.0 111.375 169.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.63 125.31 6.9 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 168.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -128.24 19.66 6.37 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.79 1.236 . . . . 0.0 114.272 -171.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.07 166.61 17.75 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.454 1.102 . . . . 0.0 112.274 169.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.86 154.55 39.42 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.101 0.56 . . . . 0.0 110.587 172.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -117.5 136.3 53.33 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.844 1.258 . . . . 0.0 112.032 176.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.26 140.83 78.35 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.046 1.738 . . . . 0.0 113.224 -170.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.6 -3.52 13.63 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.687 2.258 . . . . 0.0 114.203 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -125.55 -28.06 3.35 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.9 p -138.06 -172.94 3.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.06 -2.29 56.42 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -78.96 153.97 29.95 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -173.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -116.12 149.28 39.25 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.431 1.492 . . . . 0.0 114.191 -176.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.49 157.73 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.768 1.227 . . . . 0.0 113.091 170.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.2 ppp? -99.82 -178.47 3.87 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.655 1.582 . . . . 0.0 112.119 171.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -65.81 9.5 0.13 Allowed 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 118.384 2.735 . . . . 0.0 118.384 -168.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -64.66 -37.61 88.17 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 119.97 1.259 . . . . 0.0 112.072 172.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.79 -41.86 1.26 Allowed Glycine 0 CA--C 1.535 1.336 0 C-N-CA 125.921 1.724 . . . . 0.0 117.063 169.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.9 p -67.57 -32.48 73.26 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.853 1.826 . . . . 0.0 113.214 -177.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -70.17 -41.87 73.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.488 1.515 . . . . 0.0 112.648 171.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.08 -43.91 97.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.003 0.921 . . . . 0.0 111.771 171.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -57.82 -46.6 84.46 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.177 0.591 . . . . 0.0 111.109 176.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -62.73 -42.36 99.62 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.436 0.694 . . . . 0.0 112.614 174.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -62.42 -36.98 84.06 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 112.697 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.4 mt -73.8 -48.71 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 O-C-N 121.053 -1.029 . . . . 0.0 111.401 176.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -54.08 -30.29 47.68 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.397 0.679 . . . . 0.0 112.217 174.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -37.96 76.24 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.18 0.992 . . . . 0.0 113.109 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -67.01 -32.96 74.54 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.942 0.792 . . . . 0.0 112.141 170.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -73.96 0.47 13.41 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.428 1.091 . . . . 0.0 113.821 169.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.62 11.46 84.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.978 1.275 . . . . 0.0 115.482 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.56 137.12 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.721 1.208 . . . . 0.0 110.277 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.811 1.645 . . . . 0.0 111.421 -178.738 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 60.4 p -74.08 157.62 35.73 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.574 1.149 . . . . 0.0 113.039 176.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.2 t -152.57 162.61 40.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.958 1.303 . . . . 0.0 111.905 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.86 176.79 46.36 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.216 1.389 . . . . 0.0 115.128 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.2 m -68.49 152.14 45.81 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.841 1.256 . . . . 0.0 113.101 -178.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 20.8 m 54.69 33.91 20.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.53 1.532 . . . . 0.0 114.576 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.15 12.24 5.62 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.664 1.602 . . . . 0.0 116.591 -174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -66.33 148.49 51.78 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 118.973 1.387 . . . . 0.0 112.672 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -149.31 174.06 12.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.548 1.539 . . . . 0.0 112.223 -168.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.43 148.48 41.08 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.512 -0.742 . . . . 0.0 110.588 173.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -105.66 137.17 43.96 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.28 1.432 . . . . 0.0 112.484 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -55.63 134.69 71.53 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.234 1.414 . . . . 0.0 112.422 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.44 -4.08 14.6 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.1 2.533 . . . . 0.0 114.108 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -120.91 -30.2 4.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . 0.25 16.1 p -125.69 -132.34 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.274 1.03 . . . . 0.0 112.651 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -139.14 11.23 2.59 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.328 1.851 . . . . 0.0 112.98 -175.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -81.99 149.5 28.11 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.139 -0.976 . . . . 0.0 112.301 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -112.26 146.52 38.04 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -138.38 152.02 48.03 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.953 1.301 . . . . 0.0 112.901 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 96.6 mmm -84.18 -172.56 4.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.963 1.305 . . . . 0.0 111.576 170.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -65.91 -2.84 4.26 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -76.2 65.52 2.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.529 1.532 . . . . 0.0 111.201 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.58 -18.64 59.22 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.12 1.343 . . . . 0.0 115.681 -170.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -58.79 -32.92 69.76 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 118.82 1.31 . . . . 0.0 113.338 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -88.56 -27.92 21.08 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 176.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.87 -37.86 88.57 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.537 -0.727 . . . . 0.0 111.375 170.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -57.03 -43.81 82.28 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.653 -0.654 . . . . 0.0 111.243 172.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -63.15 -43.78 97.33 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.032 0.833 . . . . 0.0 112.322 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -61.08 -38.57 86.74 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.606 0.763 . . . . 0.0 112.589 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.8 mt -74.39 -48.91 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.207 -0.933 . . . . 0.0 111.782 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.9 m0 -52.9 -30.94 37.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.599 0.759 . . . . 0.0 112.555 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.57 -37.28 76.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.113 0.965 . . . . 0.0 113.064 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -68.15 -31.6 71.28 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.502 -0.749 . . . . 0.0 112.13 171.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -74.72 0.36 15.52 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.317 1.047 . . . . 0.0 113.672 169.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.37 12.78 83.48 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.217 1.389 . . . . 0.0 115.375 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.2 t -79.19 136.79 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 C-N-CA 126.078 1.751 . . . . 0.0 111.741 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 60.9 m -90.11 -9.51 48.08 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -177.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.3 m -67.52 150.27 49.07 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.918 1.287 . . . . 0.0 113.02 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.99 144.76 43.76 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 123.758 0.694 . . . . 0.0 113.379 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.2 m -111.61 12.44 21.23 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.12 1.368 . . . . 0.0 113.861 -176.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.7 p -147.06 168.96 20.25 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.673 1.589 . . . . 0.0 112.507 -177.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.79 69.38 1.52 Allowed Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.609 1.576 . . . . 0.0 113.973 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -81.88 -9.75 59.5 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.874 1.67 . . . . 0.0 114.209 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -139.34 166.29 24.95 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.491 1.916 . . . . 0.0 111.5 174.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 156.36 24.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.175 0.99 . . . . 0.0 110.69 172.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -116.59 138.26 51.56 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.592 1.157 . . . . 0.0 112.623 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.97 139.05 78.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.787 1.635 . . . . 0.0 112.556 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -71.66 -3.49 13.2 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.811 2.34 . . . . 0.0 113.702 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -126.83 -28.16 2.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.25 -172.68 3.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -176.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.29 -3.72 55.81 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.229 1.412 . . . . 0.0 114.054 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -82.99 155.4 23.98 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -171.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -118.88 149.21 41.95 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.619 1.568 . . . . 0.0 113.905 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -139.38 159.39 42.26 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.758 1.223 . . . . 0.0 112.431 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 92.3 mmm -78.56 160.96 27.34 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.999 0.92 . . . . 0.0 112.199 173.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -61.52 -13.2 19.28 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.365 1.987 . . . . 0.0 116.365 -170.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -64.28 -34.56 78.4 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.416 1.086 . . . . 0.0 112.506 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.36 -0.3 33.64 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 117.49 1.756 . . . . 0.0 117.49 169.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -60.3 -40.16 89.53 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.608 1.704 . . . . 0.0 114.14 -169.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -94.16 -19.7 20.54 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.817 0.847 . . . . 0.0 112.898 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 tp -61.91 -40.04 94.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.997 0.919 . . . . 0.0 111.597 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -55.61 -45.09 77.56 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 118.324 0.511 . . . . 0.0 111.266 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -66.77 -43.21 84.63 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.718 1.207 . . . . 0.0 112.053 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -60.34 -38.46 83.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.681 1.192 . . . . 0.0 112.66 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.4 mt -74.68 -48.52 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 121.075 -1.015 . . . . 0.0 111.576 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -53.49 -29.48 36.35 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.155 0.582 . . . . 0.0 112.433 173.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -39.95 70.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.906 0.882 . . . . 0.0 112.945 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -65.48 -34.09 77.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.909 0.777 . . . . 0.0 112.177 170.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.26 -5.34 41.5 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.438 1.095 . . . . 0.0 113.882 172.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.45 23.38 75.63 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.486 1.041 . . . . 0.0 114.933 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.12 138.36 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.803 1.241 . . . . 0.0 110.866 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 99.5 mttt . . . . . 0 C--O 1.252 1.231 0 C-N-CA 126.34 1.856 . . . . 0.0 111.591 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.0 p -74.78 158.38 33.59 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.699 1.199 . . . . 0.0 113.158 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.7 t -149.29 152.0 35.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 111.492 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.02 -41.39 1.27 Allowed Glycine 0 CA--C 1.539 1.552 0 C-N-CA 125.974 1.75 . . . . 0.0 114.985 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.8 t -152.67 151.71 30.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.867 1.667 . . . . 0.0 111.691 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.8 p -86.14 -10.02 55.58 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.115 1.366 . . . . 0.0 113.387 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.93 178.61 48.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.093 1.33 . . . . 0.0 114.352 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 86.7 mtm180 -131.5 156.8 45.04 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.894 1.678 . . . . 0.0 112.0 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.07 168.63 20.47 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.135 1.774 . . . . 0.0 111.236 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.93 149.19 29.51 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.407 0.683 . . . . 0.0 110.082 169.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -114.97 139.12 50.09 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.583 1.153 . . . . 0.0 111.775 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.02 137.29 80.09 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.96 1.304 . . . . 0.0 112.204 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.06 -4.06 13.47 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 122.958 2.439 . . . . 0.0 114.138 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -127.54 -27.55 2.86 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.6 p -137.7 -171.08 2.91 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -85.02 -5.87 59.34 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.846 1.258 . . . . 0.0 114.308 -173.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -75.04 152.64 38.66 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -117.47 150.12 39.45 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.743 1.617 . . . . 0.0 113.154 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -133.34 144.79 49.86 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.985 1.314 . . . . 0.0 110.573 169.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.7 tpt -95.37 130.7 42.07 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.628 0.771 . . . . 0.0 110.17 169.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 57.24 171.27 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.64 1.976 . . . . 0.0 114.129 -169.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -80.03 155.0 27.8 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.422 1.089 . . . . 0.0 111.806 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.25 163.91 29.54 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 123.647 0.641 . . . . 0.0 114.025 176.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -63.94 -25.19 68.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -72.41 -28.68 63.13 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.353 -0.842 . . . . 0.0 112.63 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp -71.4 -40.6 70.4 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.634 -0.666 . . . . 0.0 110.548 168.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -60.33 -43.65 96.22 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.79 -0.569 . . . . 0.0 110.779 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.5 ttp85 -58.9 -46.36 88.06 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.084 1.354 . . . . 0.0 112.845 171.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -60.49 -36.94 79.51 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.943 0.897 . . . . 0.0 112.451 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.2 mt -75.08 -49.06 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.089 0.956 . . . . 0.0 111.831 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -54.58 -28.48 46.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.862 0.865 . . . . 0.0 112.55 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.17 -37.55 75.22 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.821 0.848 . . . . 0.0 112.964 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -68.68 -33.83 74.63 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.452 -0.78 . . . . 0.0 112.138 171.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.0 -3.58 27.0 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.57 19.28 79.36 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 124.766 1.175 . . . . 0.0 115.361 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.9 t -68.62 142.57 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.586 1.554 . . . . 0.0 111.051 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.2 mttp . . . . . 0 C--O 1.255 1.356 0 C-N-CA 125.968 1.707 . . . . 0.0 112.009 -173.312 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m -74.05 -20.33 60.33 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -173.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 52.8 m -137.23 144.14 42.64 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.616 1.567 . . . . 0.0 111.67 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.35 164.6 47.68 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.334 0.968 . . . . 0.0 113.899 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.0 p -79.61 155.21 28.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.071 1.349 . . . . 0.0 112.485 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 44.5 m -76.23 140.74 41.77 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.072 0.949 . . . . 0.0 113.164 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 65.53 -162.3 41.32 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.57 1.081 . . . . 0.0 114.717 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mmm180 -83.83 58.32 4.59 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.215 1.406 . . . . 0.0 111.682 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.99 163.37 24.76 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.507 1.123 . . . . 0.0 113.512 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -113.88 137.62 51.42 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.446 2.298 . . . . 0.0 109.037 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -111.98 131.1 55.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.892 1.277 . . . . 0.0 112.154 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.0 t -53.95 139.53 53.0 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.335 1.454 . . . . 0.0 112.87 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -73.32 -2.68 12.45 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.689 2.259 . . . . 0.0 114.036 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -124.86 -27.85 3.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.4 p -138.79 -174.9 3.96 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -83.09 -1.45 52.83 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.081 1.352 . . . . 0.0 114.545 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.26 146.36 43.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.93 148.64 30.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -134.25 173.37 11.68 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.49 1.916 . . . . 0.0 110.743 170.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.8 ttp -140.45 148.09 40.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.764 1.225 . . . . 0.0 111.265 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt 51.5 29.53 5.46 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 126.401 1.881 . . . . 0.0 115.102 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.8 t30 49.48 45.44 23.96 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.094 1.757 . . . . 0.0 113.792 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.09 149.25 45.25 Favored Glycine 0 CA--C 1.537 1.451 0 C-N-CA 123.921 0.772 . . . . 0.0 113.474 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.8 p -64.05 -18.41 64.32 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -65.46 -23.51 66.94 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.084 -1.01 . . . . 0.0 113.129 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.1 tp -63.17 -40.67 98.23 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.324 0.966 . . . . 0.0 111.554 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -61.75 -42.71 99.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.134 0.573 . . . . 0.0 110.906 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.4 mtm180 -66.92 -41.56 86.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.909 0.884 . . . . 0.0 112.204 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -63.97 -38.04 89.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 112.678 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.1 mt -73.28 -48.09 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.004 -1.06 . . . . 0.0 111.309 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 15.4 m0 -51.5 -31.43 23.8 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.277 0.631 . . . . 0.0 112.608 172.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.31 -38.92 71.7 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.502 0.721 . . . . 0.0 112.86 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.7 -33.34 75.41 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.57 -0.706 . . . . 0.0 112.279 170.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -73.89 -2.58 24.44 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.546 1.138 . . . . 0.0 113.781 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.94 16.95 80.33 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.916 1.246 . . . . 0.0 115.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 41.1 t -73.92 135.18 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.995 1.318 . . . . 0.0 110.607 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 C--O 1.253 1.252 0 C-N-CA 126.431 1.893 . . . . 0.0 111.517 179.028 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 m -66.74 146.81 54.05 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.357 1.063 . . . . 0.0 112.864 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.5 t -135.4 -57.31 0.8 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.155 0.982 . . . . 0.0 113.203 -171.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 55.74 -148.88 26.22 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 124.241 0.924 . . . . 0.0 114.743 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.0 p -78.16 -22.77 48.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.4 p -85.41 -12.01 53.06 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.292 1.437 . . . . 0.0 113.792 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.85 5.44 74.87 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 125.424 1.487 . . . . 0.0 115.124 -177.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ptt-85 -159.97 150.96 19.21 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 118.852 1.326 . . . . 0.0 114.105 -170.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.19 170.41 16.16 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.951 0.9 . . . . 0.0 111.827 168.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.73 153.35 20.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.681 1.192 . . . . 0.0 110.755 171.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -115.32 138.13 51.3 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.714 1.205 . . . . 0.0 112.288 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 40.7 t -57.33 137.5 81.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.237 1.415 . . . . 0.0 112.522 -173.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.85 -4.46 14.12 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 122.987 2.458 . . . . 0.0 114.061 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -128.56 -26.84 2.69 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -135.45 -174.44 3.63 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.26 -4.46 57.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.884 1.273 . . . . 0.0 113.961 -174.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -81.98 153.56 26.17 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -116.15 147.76 41.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.591 1.557 . . . . 0.0 114.022 -177.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -140.77 160.18 40.6 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.675 1.59 . . . . 0.0 110.426 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.5 ttt -150.92 128.64 11.57 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.047 -1.033 . . . . 0.0 111.215 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . 0.287 62.9 pttt 47.98 27.27 1.15 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.835 2.054 . . . . 0.0 115.577 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -86.47 -11.06 52.86 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.883 1.273 . . . . 0.0 113.993 -177.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.39 -121.98 28.21 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.502 1.049 . . . . 0.0 113.66 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m -55.89 -25.69 43.9 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.09 1.356 . . . . 0.0 114.334 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.99 -31.77 69.63 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.463 -0.773 . . . . 0.0 112.69 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 49.3 tp -74.82 -39.25 61.75 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.735 -0.603 . . . . 0.0 110.584 169.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.62 -44.69 93.35 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.556 -0.715 . . . . 0.0 111.462 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -69.13 -32.54 71.99 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.29 -37.54 87.65 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.974 0.806 . . . . 0.0 111.79 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.91 -49.43 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.353 -0.842 . . . . 0.0 111.811 176.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.5 m0 -54.31 -29.4 47.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.328 0.651 . . . . 0.0 112.644 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.39 -37.98 77.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.033 0.933 . . . . 0.0 113.047 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -67.88 -32.55 73.11 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.414 -0.804 . . . . 0.0 112.165 171.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.93 -0.52 16.38 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.361 1.064 . . . . 0.0 113.712 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.66 13.81 82.76 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.0 1.286 . . . . 0.0 115.377 175.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -74.86 134.24 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 118.457 1.129 . . . . 0.0 110.478 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 126.234 1.814 . . . . 0.0 112.896 179.866 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 112.144 -0.383 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 m -68.41 153.2 44.22 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 113.226 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 87.9 p -144.73 166.29 25.62 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.63 1.572 . . . . 0.0 112.171 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.45 -149.04 39.75 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.015 0.817 . . . . 0.0 113.465 -176.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -62.63 146.58 51.71 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.722 1.209 . . . . 0.0 113.584 -176.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 t -78.6 168.69 19.4 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.474 1.11 . . . . 0.0 112.649 176.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.42 -160.87 51.24 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.909 1.242 . . . . 0.0 113.963 -177.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -131.81 161.57 32.61 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.994 1.718 . . . . 0.0 112.098 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.29 165.51 27.22 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.761 1.624 . . . . 0.0 112.366 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.4 150.99 28.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.354 1.062 . . . . 0.0 109.632 168.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -113.19 141.03 47.43 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.229 1.012 . . . . 0.0 111.355 171.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 44.4 t -55.05 139.57 63.72 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.552 1.541 . . . . 0.0 112.573 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -71.21 -4.88 15.81 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.046 2.497 . . . . 0.0 114.03 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -126.4 -25.84 3.41 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.0 p -135.48 -166.97 1.93 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.241 1.016 . . . . 0.0 113.302 177.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -104.91 16.25 26.29 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.209 1.403 . . . . 0.0 113.461 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -78.55 146.35 34.31 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.851 0.861 . . . . 0.0 111.973 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.35 147.56 38.95 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.794 1.238 . . . . 0.0 113.955 -176.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -131.48 135.75 47.36 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.898 1.279 . . . . 0.0 110.366 169.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -74.56 -33.36 62.69 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.439 -0.788 . . . . 0.0 112.091 176.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -108.95 156.93 19.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.17 1.788 . . . . 0.0 112.162 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -105.79 133.56 50.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.954 1.302 . . . . 0.0 109.367 169.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.36 -165.21 38.22 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.636 0.636 . . . . 0.0 114.148 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -60.9 -36.44 79.24 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -173.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.81 -31.47 69.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.089 -1.007 . . . . 0.0 112.439 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 47.0 tp -72.87 -40.28 65.78 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.551 0.74 . . . . 0.0 110.8 169.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.92 -34.51 77.61 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.174 -0.954 . . . . 0.0 112.125 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -64.65 -47.21 79.33 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.916 1.287 . . . . 0.0 112.098 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -57.84 -37.16 73.37 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.414 0.686 . . . . 0.0 112.21 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 80.0 mt -73.76 -48.82 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.012 0.925 . . . . 0.0 112.061 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.3 m0 -53.83 -28.16 33.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.608 0.763 . . . . 0.0 112.846 174.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.87 74.71 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.505 0.722 . . . . 0.0 112.841 175.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -71.32 -34.02 70.2 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.454 0.702 . . . . 0.0 112.216 171.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.73 -5.74 36.16 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 170.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.64 23.76 74.32 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.618 1.104 . . . . 0.0 114.935 175.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -64.74 137.69 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.873 1.269 . . . . 0.0 110.955 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm . . . . . 0 C--O 1.254 1.299 0 C-N-CA 125.367 1.467 . . . . 0.0 112.692 -175.699 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.137 -0.385 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.7 p -147.51 162.02 39.92 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.387 1.475 . . . . 0.0 112.553 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m -68.04 150.41 48.48 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.61 1.164 . . . . 0.0 113.035 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.88 -166.59 35.68 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.354 0.978 . . . . 0.0 113.646 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.9 m -73.91 8.18 2.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.56 1.544 . . . . 0.0 115.163 -174.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.5 m -65.69 -20.98 66.5 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.221 1.808 . . . . 0.0 114.563 -176.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -60.13 119.65 19.36 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.226 0.917 . . . . 0.0 112.789 -177.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 55.53 17.29 2.19 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.685 1.994 . . . . 0.0 115.167 -174.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.34 162.29 16.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.865 1.266 . . . . 0.0 112.686 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -74.66 134.52 41.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.016 1.327 . . . . 0.0 109.128 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.69 132.7 54.43 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.302 1.041 . . . . 0.0 112.169 172.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -55.8 137.27 71.81 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.385 1.074 . . . . 0.0 111.729 -178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -72.16 -2.84 12.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.792 2.328 . . . . 0.0 114.217 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -127.22 -25.83 3.18 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.3 p -136.06 179.65 6.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.38 -3.28 49.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -173.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -80.15 151.23 29.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -171.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -111.9 151.4 29.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.585 1.554 . . . . 0.0 115.01 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -133.74 148.36 51.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.997 1.719 . . . . 0.0 110.304 173.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.5 ptm -74.75 -32.21 62.02 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -148.91 161.51 41.72 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.069 2.148 . . . . 0.0 111.246 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -74.51 149.58 40.2 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.86 0.864 . . . . 0.0 110.493 168.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 172.33 179.52 43.24 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.577 1.084 . . . . 0.0 113.393 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.6 p -60.75 -29.52 69.44 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -71.15 -37.59 72.25 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.535 0.734 . . . . 0.0 112.394 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp -67.88 -42.92 80.49 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.264 0.625 . . . . 0.0 110.909 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -58.23 -43.77 87.94 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.857 -0.527 . . . . 0.0 111.092 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -66.4 -39.57 89.11 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.142 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -61.93 -37.13 83.54 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.315 1.046 . . . . 0.0 112.317 173.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.9 mt -72.1 -47.6 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 O-C-N 121.04 -1.037 . . . . 0.0 111.36 174.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -56.45 -25.81 51.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.533 0.733 . . . . 0.0 112.67 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.27 -37.88 66.12 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.122 -0.986 . . . . 0.0 112.775 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -67.96 -33.89 75.52 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.548 -0.72 . . . . 0.0 112.037 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -72.52 -4.72 32.28 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.98 1.312 . . . . 0.0 114.037 170.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.3 27.18 66.43 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.413 1.006 . . . . 0.0 114.936 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 44.6 t -79.39 134.19 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.14 1.376 . . . . 0.0 111.117 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 127.464 2.306 . . . . 0.0 112.163 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.1 p -62.69 -25.22 68.05 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.7 p -58.47 -26.31 63.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.954 1.302 . . . . 0.0 113.451 171.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.62 -15.56 73.37 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.427 1.013 . . . . 0.0 114.488 172.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.5 m -108.18 -39.7 5.4 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.147 1.379 . . . . 0.0 112.577 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 63.7 m -77.86 -20.12 53.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 177.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -60.0 123.43 33.09 Favored Glycine 0 CA--C 1.534 1.279 0 O-C-N 121.303 -0.873 . . . . 0.0 112.71 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 53.03 28.56 6.87 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 126.178 1.791 . . . . 0.0 114.312 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -139.92 171.54 14.06 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.702 1.601 . . . . 0.0 112.467 -177.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -108.08 138.82 43.68 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.874 1.67 . . . . 0.0 109.468 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -113.97 131.56 56.29 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.024 1.33 . . . . 0.0 112.583 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -55.79 140.29 68.19 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.351 1.46 . . . . 0.0 112.861 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -74.36 -3.65 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.828 2.352 . . . . 0.0 114.098 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -124.99 -28.69 3.43 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -135.89 -177.22 4.59 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.242 1.017 . . . . 0.0 113.693 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -81.74 -0.67 44.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.997 1.319 . . . . 0.0 114.446 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -75.08 149.92 39.0 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.04 151.16 29.66 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.361 1.464 . . . . 0.0 114.595 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -127.88 151.03 49.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.483 1.513 . . . . 0.0 112.557 173.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 ptm -140.11 26.67 2.21 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.21 2.204 . . . . 0.0 111.784 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -131.44 172.66 11.93 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.18 2.192 . . . . 0.0 111.927 -169.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -59.94 148.51 34.9 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.383 1.073 . . . . 0.0 112.166 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.75 -23.6 61.25 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.865 1.221 . . . . 0.0 115.327 -171.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 m -63.26 -32.68 74.15 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.908 1.354 . . . . 0.0 113.366 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.42 -33.55 32.1 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.418 0.687 . . . . 0.0 111.94 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.5 tp -65.94 -40.2 91.15 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.632 1.173 . . . . 0.0 111.929 169.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -60.94 -32.39 71.9 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.269 -0.894 . . . . 0.0 112.123 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -68.34 -41.88 80.11 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.189 0.995 . . . . 0.0 112.556 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -64.09 -34.87 79.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.745 0.818 . . . . 0.0 112.032 174.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.1 mt -72.62 -48.66 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 121.221 -0.924 . . . . 0.0 111.638 175.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -53.75 -28.41 34.36 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 112.852 173.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.46 -37.84 74.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.484 0.714 . . . . 0.0 112.681 175.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -69.8 -34.05 73.19 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.438 0.695 . . . . 0.0 112.267 171.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -72.5 -4.77 32.47 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.09 23.68 73.67 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.595 1.093 . . . . 0.0 115.063 175.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.6 t -67.02 141.55 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.749 1.219 . . . . 0.0 111.124 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.7 mttt . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.193 1.797 . . . . 0.0 111.787 -179.76 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 m -74.75 -17.58 60.62 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 t -150.81 156.5 41.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 111.706 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.84 68.08 2.84 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.406 1.479 . . . . 0.0 112.996 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.4 p -72.47 168.87 17.61 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.905 1.282 . . . . 0.0 113.652 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 m -75.83 2.39 12.45 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.97 176.17 33.78 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 125.165 1.364 . . . . 0.0 114.535 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.29 146.54 50.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.003 1.321 . . . . 0.0 111.628 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.02 175.39 9.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.876 1.271 . . . . 0.0 113.831 -174.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.26 170.99 14.73 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.691 1.996 . . . . 0.0 111.19 178.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -113.37 135.24 54.08 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.793 1.637 . . . . 0.0 111.416 176.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.7 t -56.68 141.1 74.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.571 1.548 . . . . 0.0 113.032 -169.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -73.04 -3.32 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.517 2.145 . . . . 0.0 113.94 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -126.28 -25.71 3.46 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.2 p -138.5 -177.01 4.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.458 1.103 . . . . 0.0 113.519 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -81.27 -6.14 58.55 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -81.7 151.53 27.48 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -105.31 147.9 27.63 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.299 1.44 . . . . 0.0 113.788 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -136.26 149.35 48.45 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.649 1.18 . . . . 0.0 111.202 169.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.7 ptm -74.75 171.36 14.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.061 0.944 . . . . 0.0 112.884 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -63.34 16.65 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -75.61 -17.67 59.94 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.46 -60.75 2.39 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.507 1.527 . . . . 0.0 114.432 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 m -64.27 -37.93 89.22 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -75.3 -31.93 60.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.518 -0.739 . . . . 0.0 111.923 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 50.7 tp -69.81 -42.44 73.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.093 0.957 . . . . 0.0 111.701 169.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -58.4 -45.55 88.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.845 0.858 . . . . 0.0 111.469 -178.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -68.64 -31.65 70.94 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -68.66 -37.18 79.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.595 0.758 . . . . 0.0 112.555 173.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -72.36 -47.09 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 O-C-N 121.021 -1.049 . . . . 0.0 111.221 175.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -52.7 -30.31 31.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.377 0.671 . . . . 0.0 112.655 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.99 68.17 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 176.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -65.76 -34.08 77.35 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.873 0.76 . . . . 0.0 112.079 170.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -73.73 -0.39 15.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.929 1.292 . . . . 0.0 113.895 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.77 14.81 82.17 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.083 1.325 . . . . 0.0 115.368 174.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.0 t -77.56 134.5 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.926 1.291 . . . . 0.0 110.671 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.615 1.966 . . . . 0.0 111.413 178.751 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.537 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 t -148.41 156.16 42.14 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.259 1.423 . . . . 0.0 111.649 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.4 p -150.1 161.4 42.44 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.449 1.5 . . . . 0.0 112.65 -178.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.61 179.88 48.8 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.841 1.21 . . . . 0.0 113.215 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.5 t -148.83 149.36 31.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.963 1.305 . . . . 0.0 111.799 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.3 m 55.7 22.35 5.32 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.376 1.87 . . . . 0.0 115.975 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 141.0 30.01 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.297 0.951 . . . . 0.0 113.017 177.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 45.6 ttp85 -133.95 13.29 3.97 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.168 1.387 . . . . 0.0 113.927 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.88 160.64 31.12 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.417 1.087 . . . . 0.0 112.812 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -82.88 128.82 34.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.066 1.346 . . . . 0.0 109.814 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -96.07 129.07 43.45 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.39 0.995 . . . . 0.0 111.473 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.7 t -52.8 137.33 44.7 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.947 0.899 . . . . 0.0 111.744 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -70.56 -2.91 11.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.915 2.41 . . . . 0.0 114.226 -178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -126.62 -25.17 3.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.9 p -140.14 -179.3 5.9 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.83 1.37 50.05 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -173.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -76.83 139.85 40.46 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.248 -0.908 . . . . 0.0 113.149 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -95.97 149.1 21.95 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -141.03 169.01 18.42 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.849 2.06 . . . . 0.0 112.336 -175.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -118.89 167.25 11.89 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.548 1.939 . . . . 0.0 109.156 169.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -71.39 40.19 0.06 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.884 2.074 . . . . 0.0 113.859 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.1 55.13 2.71 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.543 1.937 . . . . 0.0 111.951 -173.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.04 -124.2 33.48 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 124.703 1.144 . . . . 0.0 113.624 175.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -72.82 -8.39 55.27 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.75 -29.44 68.66 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.685 1.13 . . . . 0.0 113.421 -176.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp -81.28 -40.21 24.06 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.74 0.816 . . . . 0.0 111.006 168.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -61.02 -43.87 98.25 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 111.537 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -62.01 -33.84 75.09 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.941 0.896 . . . . 0.0 113.357 176.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -73.2 -36.67 66.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.152 0.981 . . . . 0.0 111.962 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.64 -48.46 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 121.283 -0.885 . . . . 0.0 111.553 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -54.39 -27.78 38.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.924 0.889 . . . . 0.0 112.644 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.39 -39.5 67.94 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 174.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.63 -34.47 77.94 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.701 0.682 . . . . 0.0 112.092 171.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.11 -7.28 51.98 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.388 1.075 . . . . 0.0 113.748 172.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.42 25.55 74.03 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.536 1.065 . . . . 0.0 114.847 177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 76.2 t -62.53 139.13 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.273 1.429 . . . . 0.0 111.34 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.953 1.701 . . . . 0.0 112.33 -176.036 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.607 0 N-CA-C 111.303 -0.719 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 m 56.01 28.27 12.53 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 175.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 t -151.23 152.77 33.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.411 1.484 . . . . 0.0 111.64 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 170.4 179.23 41.72 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 125.189 1.376 . . . . 0.0 113.146 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.4 m 51.99 38.94 25.15 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.518 1.527 . . . . 0.0 114.733 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.3 t -140.34 165.59 27.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.46 1.504 . . . . 0.0 112.321 -176.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.83 179.72 40.82 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.239 1.4 . . . . 0.0 114.956 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -77.24 45.73 0.47 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.516 1.926 . . . . 0.0 114.459 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 155.72 29.98 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.745 1.218 . . . . 0.0 113.285 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -77.02 135.91 38.68 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 125.764 1.626 . . . . 0.0 109.717 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -108.93 131.72 54.77 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.509 1.124 . . . . 0.0 111.952 171.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.1 t -54.51 138.38 60.27 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.519 1.127 . . . . 0.0 112.011 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.33 -2.77 12.21 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.913 2.409 . . . . 0.0 114.151 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -124.86 -28.0 3.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.1 -179.47 5.8 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -87.95 7.92 28.77 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -78.24 141.62 38.45 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.127 -0.983 . . . . 0.0 112.829 175.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.04 153.77 21.57 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.468 1.507 . . . . 0.0 114.068 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -130.0 140.09 50.94 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.714 1.606 . . . . 0.0 110.494 173.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -99.56 0.08 41.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.025 1.33 . . . . 0.0 113.824 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -146.08 142.72 28.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.883 1.673 . . . . 0.0 111.497 -172.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -92.5 147.98 22.46 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.479 1.111 . . . . 0.0 111.444 169.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.68 -158.38 30.56 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.439 1.019 . . . . 0.0 112.457 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.0 p -75.59 -25.54 57.11 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -64.34 -41.0 96.99 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.322 -0.861 . . . . 0.0 112.881 -173.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 59.0 tp -66.87 -38.1 85.67 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.095 0.558 . . . . 0.0 111.627 172.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -65.31 -43.63 90.45 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.64 -0.663 . . . . 0.0 111.279 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.4 mtm-85 -61.16 -43.51 98.77 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 118.807 0.73 . . . . 0.0 112.158 171.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -60.31 -37.6 81.09 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.343 0.657 . . . . 0.0 112.372 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.1 mt -74.4 -49.3 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.033 0.933 . . . . 0.0 111.786 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -54.01 -30.14 46.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 112.388 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.8 78.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.314 1.045 . . . . 0.0 113.134 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -67.88 -32.0 72.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.943 0.792 . . . . 0.0 112.075 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.5 0.76 13.71 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.327 1.051 . . . . 0.0 113.705 169.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.23 11.58 84.16 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.119 1.342 . . . . 0.0 115.467 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.0 t -79.62 136.65 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.798 1.239 . . . . 0.0 110.474 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 126.489 1.916 . . . . 0.0 111.581 179.97 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.504 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.7 p -63.7 -14.68 54.42 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.761 1.225 . . . . 0.0 114.189 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.2 p -67.25 -16.17 64.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.977 2.111 . . . . 0.0 114.514 169.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.4 154.24 53.14 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.554 1.074 . . . . 0.0 113.958 178.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.0 t -150.56 151.1 32.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.979 1.312 . . . . 0.0 112.088 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.2 p -78.33 -12.12 59.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.278 1.431 . . . . 0.0 113.488 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.54 -124.86 35.75 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.277 0.941 . . . . 0.0 112.634 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 93.5 mtm-85 -84.73 -6.67 59.36 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.836 1.254 . . . . 0.0 114.267 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -103.26 173.05 6.48 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.214 1.406 . . . . 0.0 113.17 -174.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -116.71 132.87 56.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.438 1.895 . . . . 0.0 109.302 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -98.51 128.55 44.9 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.513 1.051 . . . . 0.0 111.917 175.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.4 t -53.84 139.51 51.95 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 124.483 1.113 . . . . 0.0 112.24 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -72.67 -2.42 11.83 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 122.732 2.288 . . . . 0.0 114.214 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -125.37 -26.48 3.6 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.8 p -138.77 177.36 7.94 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -83.6 0.88 44.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -174.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -80.47 145.28 31.98 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.255 -0.903 . . . . 0.0 113.285 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -101.23 151.86 21.35 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.149 1.38 . . . . 0.0 114.6 -178.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -128.53 160.65 31.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.996 2.118 . . . . 0.0 111.274 174.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.94 159.68 43.26 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.417 1.487 . . . . 0.0 110.97 -176.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 52.54 -114.23 0.82 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.451 1.9 . . . . 0.0 113.301 176.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -73.87 128.01 34.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.336 1.054 . . . . 0.0 112.348 -171.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.91 1.39 59.1 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.067 1.318 . . . . 0.0 115.543 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.3 p -60.1 -37.45 80.02 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.377 1.588 . . . . 0.0 113.365 178.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -81.81 -34.11 30.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.108 0.963 . . . . 0.0 112.495 176.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.7 tp -62.35 -41.98 99.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.77 0.828 . . . . 0.0 111.786 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -59.33 -46.1 89.54 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.908 -0.495 . . . . 0.0 111.784 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.0 mtm-85 -64.31 -41.08 97.0 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.234 0.614 . . . . 0.0 112.237 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -62.24 -37.75 86.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.716 0.806 . . . . 0.0 112.61 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.4 mt -73.39 -48.46 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 O-C-N 121.098 -1.001 . . . . 0.0 111.596 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 30.2 m0 -54.25 -28.89 44.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.531 0.732 . . . . 0.0 112.374 174.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.22 -39.3 71.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.813 0.845 . . . . 0.0 113.03 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -66.1 -34.41 77.99 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.444 -0.785 . . . . 0.0 112.085 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.67 -4.42 34.24 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 171.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.54 21.56 78.57 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.648 1.118 . . . . 0.0 115.057 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.64 136.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.874 1.269 . . . . 0.0 110.785 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.323 1.449 . . . . 0.0 112.723 -179.245 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.7 p -80.18 167.83 19.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.895 1.278 . . . . 0.0 113.133 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 71.2 m -78.08 -10.19 59.5 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 177.6 156.1 15.47 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.663 1.602 . . . . 0.0 112.194 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 61.1 p -65.77 -22.84 66.61 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -174.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 86.4 p -83.8 -13.62 53.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.542 1.537 . . . . 0.0 113.959 172.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 70.14 10.81 66.2 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 124.503 1.049 . . . . 0.0 114.51 -169.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.3 mtm-85 -132.91 162.74 30.8 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.965 1.706 . . . . 0.0 112.544 -173.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -148.01 161.43 41.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.7 1.6 . . . . 0.0 111.546 173.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -83.55 130.08 34.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.707 1.603 . . . . 0.0 109.887 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -95.99 127.83 42.35 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.363 0.983 . . . . 0.0 111.752 174.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.3 t -51.96 138.19 35.03 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.37 1.068 . . . . 0.0 111.912 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -73.03 -1.35 10.39 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.405 2.07 . . . . 0.0 114.065 -178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -125.77 -23.96 3.91 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.887 1.275 . . . . 0.0 114.342 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -142.17 -177.27 5.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -85.51 3.92 38.19 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -177.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -79.66 141.68 36.24 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.176 -0.952 . . . . 0.0 113.002 -178.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -101.87 148.97 24.68 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -134.18 156.01 49.11 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.797 2.039 . . . . 0.0 111.422 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.0 tpt -151.34 135.67 16.85 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.081 0.953 . . . . 0.0 110.88 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 57.73 -40.37 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 129.401 3.08 . . . . 0.0 117.968 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -82.27 80.27 8.52 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.854 1.206 . . . . 0.0 112.305 -174.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.89 70.24 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.19 0.9 . . . . 0.0 114.152 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -70.85 -44.08 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.661 1.231 . . . . 0.0 112.307 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -71.92 -32.97 67.89 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.663 -0.648 . . . . 0.0 111.888 176.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.04 -46.61 88.41 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.219 0.608 . . . . 0.0 111.24 169.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -61.0 -41.54 96.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.525 0.73 . . . . 0.0 111.376 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -62.27 -42.89 99.73 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.085 0.954 . . . . 0.0 112.328 172.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -65.13 -36.02 82.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.281 1.032 . . . . 0.0 112.713 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.1 mt -71.8 -47.07 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 O-C-N 120.814 -1.179 . . . . 0.0 111.625 175.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.4 m0 -54.56 -27.8 41.35 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.555 0.742 . . . . 0.0 112.689 171.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.91 -38.82 64.21 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.487 -0.758 . . . . 0.0 112.813 175.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -64.88 -37.17 86.74 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 118.822 0.737 . . . . 0.0 112.008 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -74.5 -4.25 35.67 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 114.278 173.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.99 27.08 74.24 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.37 0.985 . . . . 0.0 114.725 175.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.62 137.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.035 1.334 . . . . 0.0 111.229 -176.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.2 pttp . . . . . 0 C--O 1.254 1.338 0 C-N-CA 126.385 1.874 . . . . 0.0 112.724 -178.652 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.26 -0.336 . . . . 0.0 112.26 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.2 m -89.31 7.96 32.97 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.187 1.395 . . . . 0.0 114.761 -174.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.4 p -71.77 158.27 36.42 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.35 1.46 . . . . 0.0 113.588 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.94 -172.03 51.72 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.466 1.032 . . . . 0.0 114.038 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 98.2 p -150.1 161.06 43.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.953 1.301 . . . . 0.0 112.623 179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.7 m -96.39 0.24 50.28 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.018 1.327 . . . . 0.0 114.314 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.96 164.12 54.32 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.527 1.06 . . . . 0.0 114.307 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.6 ptt85 -83.46 0.74 44.96 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -177.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.48 174.74 7.0 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.643 1.177 . . . . 0.0 113.871 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 157.59 30.65 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.955 1.702 . . . . 0.0 110.978 174.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -114.28 137.3 51.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.547 1.539 . . . . 0.0 111.29 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -57.13 138.73 79.88 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 125.765 1.626 . . . . 0.0 112.383 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.37 -2.89 12.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 122.493 2.128 . . . . 0.0 113.83 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -126.43 -26.52 3.29 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.4 p -138.57 -171.69 3.12 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -79.04 -14.91 58.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.111 1.364 . . . . 0.0 113.87 -176.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -73.88 155.84 38.31 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -118.16 152.71 35.12 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.681 1.592 . . . . 0.0 113.916 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -132.53 149.14 52.37 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.679 1.191 . . . . 0.0 111.728 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -138.88 -1.07 1.83 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.467 1.507 . . . . 0.0 114.564 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -142.64 149.23 38.64 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.41 1.884 . . . . 0.0 111.193 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 55.0 t30 51.18 117.97 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 129.305 3.042 . . . . 0.0 116.996 178.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.44 82.63 Favored Glycine 0 CA--C 1.536 1.378 0 O-C-N 121.178 -0.952 . . . . 0.0 114.682 175.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.9 p -78.58 -20.97 49.33 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.801 1.8 . . . . 0.0 114.025 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -72.38 -35.47 68.47 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.364 -0.835 . . . . 0.0 111.333 169.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.79 -43.85 71.3 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.708 -0.62 . . . . 0.0 111.198 169.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -60.79 -43.44 98.1 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.611 -0.681 . . . . 0.0 111.804 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -69.97 -32.21 70.31 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -66.37 -37.37 85.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.767 0.827 . . . . 0.0 111.992 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.25 -47.31 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 O-C-N 121.1 -1.0 . . . . 0.0 111.552 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -54.21 -27.78 36.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.609 0.764 . . . . 0.0 112.902 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.29 -38.03 68.85 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.556 -0.715 . . . . 0.0 112.795 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -67.47 -35.22 78.75 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.591 -0.693 . . . . 0.0 112.075 171.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -73.84 -3.35 28.17 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.82 1.248 . . . . 0.0 114.131 171.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.37 25.16 75.96 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.487 1.042 . . . . 0.0 114.915 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.78 138.12 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.877 1.271 . . . . 0.0 111.09 -178.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.555 1.942 . . . . 0.0 111.555 178.773 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 m -66.42 152.44 45.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.428 1.091 . . . . 0.0 113.059 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.9 p -73.69 150.83 40.98 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.548 1.139 . . . . 0.0 113.267 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.75 177.39 52.36 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.747 1.165 . . . . 0.0 114.317 177.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.6 t -71.18 152.38 43.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.342 1.057 . . . . 0.0 112.426 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.6 p -73.6 -16.18 61.25 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.704 1.201 . . . . 0.0 113.398 170.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 59.95 -116.77 9.53 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 124.324 0.964 . . . . 0.0 112.977 174.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 58.6 ttm-85 -82.1 -9.58 59.48 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.203 1.401 . . . . 0.0 114.573 -178.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.14 172.67 12.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 169.5 17.37 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.73 1.612 . . . . 0.0 110.236 169.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.0 tttt -112.91 140.22 47.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.364 1.066 . . . . 0.0 111.341 170.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 37.4 t -58.31 137.69 84.98 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.735 1.214 . . . . 0.0 111.578 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -72.28 -3.37 13.21 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 122.999 2.466 . . . . 0.0 114.199 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -126.42 -27.33 3.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.2 p -135.57 -179.3 5.56 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -78.25 -2.41 37.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.866 1.267 . . . . 0.0 114.025 -175.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -83.77 154.11 23.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -170.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -118.6 148.01 43.13 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.026 1.73 . . . . 0.0 113.113 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -135.47 164.46 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.361 1.464 . . . . 0.0 110.382 168.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -144.69 136.22 25.51 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.287 1.435 . . . . 0.0 109.816 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . 0.265 63.5 pttt 51.96 -29.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 131.016 3.727 . . . . 0.0 119.422 -176.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -81.73 60.36 4.62 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.692 1.597 . . . . 0.0 112.595 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.02 -34.41 65.88 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.283 -0.885 . . . . 0.0 113.795 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.0 m -65.3 -20.47 66.42 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.602 1.161 . . . . 0.0 113.92 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.47 -34.39 12.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.198 1.399 . . . . 0.0 112.266 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -58.55 -39.76 81.11 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.013 0.925 . . . . 0.0 111.963 173.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -56.21 -40.78 74.58 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.865 -0.522 . . . . 0.0 111.98 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -66.19 -43.68 86.15 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.108 0.963 . . . . 0.0 111.411 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.77 -36.98 82.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.032 0.933 . . . . 0.0 112.32 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.7 mt -75.18 -49.39 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 O-C-N 121.313 -0.867 . . . . 0.0 111.783 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -55.5 -27.65 49.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.325 0.65 . . . . 0.0 112.478 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.17 73.16 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.717 0.807 . . . . 0.0 112.923 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.77 -33.69 76.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.943 0.792 . . . . 0.0 112.173 171.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.18 -3.28 28.82 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.8 21.29 78.79 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.694 1.14 . . . . 0.0 115.104 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.12 137.79 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.747 1.219 . . . . 0.0 110.899 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.091 0 C-N-CA 126.075 1.75 . . . . 0.0 112.997 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.63 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -76.56 160.71 29.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.753 1.221 . . . . 0.0 113.284 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.4 t -148.87 165.76 30.56 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.325 1.45 . . . . 0.0 111.601 178.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.5 154.57 52.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.597 1.094 . . . . 0.0 114.214 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.9 p -87.78 -5.27 58.72 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 -177.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -63.03 145.97 54.26 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.159 1.384 . . . . 0.0 113.432 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 179.84 174.96 46.2 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.727 1.156 . . . . 0.0 113.376 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -109.5 5.42 23.24 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.477 1.511 . . . . 0.0 114.467 -176.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.22 161.72 27.94 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -172.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -115.24 139.58 49.83 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.49 2.716 . . . . 0.0 108.681 177.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -109.91 130.56 55.51 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.938 1.295 . . . . 0.0 112.717 174.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -54.97 140.06 62.07 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.336 1.455 . . . . 0.0 112.599 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -75.34 -3.53 14.02 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.865 2.377 . . . . 0.0 114.135 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -123.84 -29.37 3.69 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.3 p -134.13 -178.47 5.05 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.47 -16.77 59.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.497 1.119 . . . . 0.0 113.915 -175.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.55 150.79 45.73 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -168.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.01 153.25 23.36 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.609 1.564 . . . . 0.0 115.189 -176.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -133.8 151.77 51.67 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.726 1.61 . . . . 0.0 111.518 170.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.2 ttp -81.96 -31.32 31.28 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.428 0.691 . . . . 0.0 110.819 167.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -88.29 164.56 15.52 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.528 1.931 . . . . 0.0 113.236 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -135.62 168.72 18.74 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 108.932 169.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.31 -139.75 23.64 Favored Glycine 0 CA--C 1.533 1.171 0 O-C-N 121.09 -1.006 . . . . 0.0 113.419 -179.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m -50.89 -42.22 59.01 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.026 1.862 . . . . 0.0 116.026 -168.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -75.44 -30.26 59.96 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.619 1.099 . . . . 0.0 113.325 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.0 tp -72.52 -35.4 68.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.811 0.844 . . . . 0.0 110.88 169.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.32 -29.28 68.76 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.403 -0.81 . . . . 0.0 112.379 -178.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -56.36 -45.63 80.39 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.172 1.389 . . . . 0.0 112.446 171.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -74.73 -32.47 62.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.066 1.347 . . . . 0.0 112.343 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.6 mt -72.13 -47.76 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.253 -0.905 . . . . 0.0 111.42 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -52.66 -29.08 24.39 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 112.94 172.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.41 73.03 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.52 0.728 . . . . 0.0 112.556 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -70.69 -32.91 70.32 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.582 0.753 . . . . 0.0 112.401 171.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.3 -3.44 23.79 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.41 18.56 75.77 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 124.759 1.171 . . . . 0.0 115.317 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.47 135.83 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 118.589 1.195 . . . . 0.0 110.413 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.458 1.903 . . . . 0.0 111.296 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.4 m -67.42 149.91 49.62 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.542 1.137 . . . . 0.0 113.108 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.3 m -67.34 143.07 56.56 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.397 1.079 . . . . 0.0 112.761 -179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.88 -2.11 90.64 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.623 1.106 . . . . 0.0 115.588 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.5 m -67.62 148.0 51.97 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.195 1.398 . . . . 0.0 113.659 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.6 m -137.29 151.73 48.99 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.699 1.6 . . . . 0.0 111.835 178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.83 -174.42 47.03 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.768 1.175 . . . . 0.0 113.09 179.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -141.02 145.79 36.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.711 1.604 . . . . 0.0 111.406 175.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -152.85 176.79 11.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.758 1.623 . . . . 0.0 111.641 175.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.4 156.73 27.42 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.881 1.672 . . . . 0.0 110.739 173.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -116.98 139.69 50.36 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.82 1.248 . . . . 0.0 111.504 172.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 41.9 t -56.96 137.35 79.67 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.874 1.27 . . . . 0.0 111.993 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -69.83 -3.68 12.54 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.086 2.524 . . . . 0.0 114.045 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.48 -28.9 2.73 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.7 p -136.75 -173.72 3.51 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -82.79 -5.07 58.76 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.807 1.243 . . . . 0.0 114.272 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -78.96 150.87 31.92 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -174.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -115.45 151.55 34.55 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.96 1.704 . . . . 0.0 113.157 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -135.19 148.33 49.65 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.475 1.51 . . . . 0.0 109.382 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 27.8 ttt -83.45 125.83 32.12 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.39 -0.819 . . . . 0.0 109.835 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt 55.33 -179.46 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.179 1.791 . . . . 0.0 113.621 -172.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -83.73 156.19 22.7 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.039 0.935 . . . . 0.0 110.392 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -178.2 172.02 44.47 Favored Glycine 0 CA--C 1.532 1.108 0 O-C-N 121.379 -0.826 . . . . 0.0 114.318 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.0 p -63.22 -36.78 84.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.942 0.897 . . . . 0.0 113.187 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -72.52 -28.4 62.83 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.086 -1.009 . . . . 0.0 112.716 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.7 tp -69.54 -39.75 77.28 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.824 -0.548 . . . . 0.0 110.445 168.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -60.94 -41.01 95.45 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.8 . . . . 0.0 111.532 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -58.99 -50.8 72.7 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.126 0.97 . . . . 0.0 112.011 169.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -58.12 -37.51 74.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.389 1.076 . . . . 0.0 112.584 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.8 mt -74.4 -50.0 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 124.083 0.953 . . . . 0.0 111.796 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.7 m0 -51.55 -32.75 29.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.231 0.612 . . . . 0.0 112.598 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.17 84.83 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.241 1.017 . . . . 0.0 112.918 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -71.74 -29.54 64.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.503 0.721 . . . . 0.0 112.631 171.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.04 -4.03 39.09 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 173.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.11 36.78 56.25 Favored Glycine 0 CA--C 1.535 1.316 0 O-C-N 121.241 -0.912 . . . . 0.0 113.74 178.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.7 p -52.87 146.43 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 125.574 1.55 . . . . 0.0 113.385 178.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt . . . . . 0 C--O 1.254 1.328 0 C-N-CA 126.322 1.849 . . . . 0.0 111.909 -177.636 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 119.041 -0.504 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -116.37 138.16 51.56 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.479 1.111 . . . . 0.0 112.567 176.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -57.07 139.53 78.9 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 126.006 1.722 . . . . 0.0 112.611 -173.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -72.3 -2.72 12.11 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.565 2.177 . . . . 0.0 114.01 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -126.38 -28.24 3.09 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.8 p -139.6 -171.39 3.13 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -175.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -82.27 -3.45 55.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.432 1.493 . . . . 0.0 114.038 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -82.66 154.97 24.63 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -171.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.475 0.804 0 C-N-CA 125.602 1.561 . . . . 0.0 114.253 -176.645 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.0 tp . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.3 mm100 -64.28 -43.85 93.51 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.676 -0.64 . . . . 0.0 110.602 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -64.45 -41.7 96.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.917 0.887 . . . . 0.0 112.255 173.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -61.82 -37.47 84.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.638 0.775 . . . . 0.0 112.549 176.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.5 mt -73.68 -47.98 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.148 -0.97 . . . . 0.0 111.548 175.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.4 m0 -55.63 -27.44 49.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -39.09 73.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.08 0.952 . . . . 0.0 112.862 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -67.35 -33.91 76.21 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.168 171.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -73.14 -0.98 15.71 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.941 1.297 . . . . 0.0 113.938 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.391 0 C-N-CA 124.777 1.179 . . . . 0.0 115.477 173.378 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.186 -0.435 . . . . 0.0 110.365 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -115.02 137.5 51.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.816 1.246 . . . . 0.0 111.741 174.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.03 138.15 83.76 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.801 1.24 . . . . 0.0 112.324 -176.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -71.35 -3.92 13.93 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.016 2.477 . . . . 0.0 114.113 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -126.61 -28.74 2.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.5 p -133.81 179.63 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -177.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.25 -4.2 54.81 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -83.86 158.56 21.6 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 . . . . . 0 N--CA 1.468 0.46 0 C-N-CA 125.917 1.687 . . . . 0.0 113.166 -174.928 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp . . . . . 0 CA--C 1.534 0.356 0 N-CA-C 111.1 0.037 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -61.26 -41.21 96.52 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.596 -0.69 . . . . 0.0 111.224 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.28 -41.41 85.49 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.515 0.726 . . . . 0.0 112.213 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -59.66 -37.36 78.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.693 0.797 . . . . 0.0 112.429 174.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -73.52 -49.46 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 O-C-N 121.327 -0.858 . . . . 0.0 111.59 176.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -50.88 -32.69 21.29 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.743 0.817 . . . . 0.0 112.531 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.47 -34.34 74.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.018 0.927 . . . . 0.0 113.274 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.3 -29.8 67.73 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.452 -0.78 . . . . 0.0 112.113 171.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.67 1.43 17.05 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.607 1.163 . . . . 0.0 113.304 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.448 0 C-N-CA 125.644 1.593 . . . . 0.0 115.382 177.855 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 119.014 -0.517 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -117.5 136.3 53.33 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.844 1.258 . . . . 0.0 112.032 176.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.26 140.83 78.35 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.046 1.738 . . . . 0.0 113.224 -170.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.6 -3.52 13.63 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.687 2.258 . . . . 0.0 114.203 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -125.55 -28.06 3.35 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.9 p -138.06 -172.94 3.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.06 -2.29 56.42 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -78.96 153.97 29.95 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -173.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 125.431 1.492 . . . . 0.0 114.191 -176.512 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.8 tp . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -57.82 -46.6 84.46 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.177 0.591 . . . . 0.0 111.109 176.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -62.73 -42.36 99.62 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.436 0.694 . . . . 0.0 112.614 174.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -62.42 -36.98 84.06 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 112.697 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.4 mt -73.8 -48.71 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 O-C-N 121.053 -1.029 . . . . 0.0 111.401 176.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -54.08 -30.29 47.68 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.397 0.679 . . . . 0.0 112.217 174.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -37.96 76.24 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.18 0.992 . . . . 0.0 113.109 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -67.01 -32.96 74.54 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.942 0.792 . . . . 0.0 112.141 170.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -73.96 0.47 13.41 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.428 1.091 . . . . 0.0 113.821 169.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.409 0 C-N-CA 124.978 1.275 . . . . 0.0 115.482 175.013 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.588 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -105.66 137.17 43.96 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.28 1.432 . . . . 0.0 112.484 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -55.63 134.69 71.53 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.234 1.414 . . . . 0.0 112.422 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.44 -4.08 14.6 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.1 2.533 . . . . 0.0 114.108 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -120.91 -30.2 4.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . 0.25 16.1 p -125.69 -132.34 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.274 1.03 . . . . 0.0 112.651 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -139.14 11.23 2.59 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.328 1.851 . . . . 0.0 112.98 -175.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -81.99 149.5 28.11 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.139 -0.976 . . . . 0.0 112.301 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.47 0.563 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -176.871 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 tp . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -57.03 -43.81 82.28 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.653 -0.654 . . . . 0.0 111.243 172.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -63.15 -43.78 97.33 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.032 0.833 . . . . 0.0 112.322 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -61.08 -38.57 86.74 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.606 0.763 . . . . 0.0 112.589 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.8 mt -74.39 -48.91 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.207 -0.933 . . . . 0.0 111.782 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.9 m0 -52.9 -30.94 37.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.599 0.759 . . . . 0.0 112.555 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.57 -37.28 76.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.113 0.965 . . . . 0.0 113.064 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -68.15 -31.6 71.28 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.502 -0.749 . . . . 0.0 112.13 171.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -74.72 0.36 15.52 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.317 1.047 . . . . 0.0 113.672 169.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 C-N-CA 125.217 1.389 . . . . 0.0 115.375 175.572 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 119.107 -0.473 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -116.59 138.26 51.56 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.592 1.157 . . . . 0.0 112.623 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.97 139.05 78.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.787 1.635 . . . . 0.0 112.556 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -71.66 -3.49 13.2 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.811 2.34 . . . . 0.0 113.702 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -126.83 -28.16 2.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.25 -172.68 3.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -176.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.29 -3.72 55.81 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.229 1.412 . . . . 0.0 114.054 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -82.99 155.4 23.98 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -171.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 . . . . . 0 N--CA 1.472 0.649 0 C-N-CA 125.619 1.568 . . . . 0.0 113.905 -176.577 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 tp . . . . . 0 N--CA 1.468 0.474 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -55.61 -45.09 77.56 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 118.324 0.511 . . . . 0.0 111.266 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -66.77 -43.21 84.63 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.718 1.207 . . . . 0.0 112.053 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -60.34 -38.46 83.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.681 1.192 . . . . 0.0 112.66 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.4 mt -74.68 -48.52 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 121.075 -1.015 . . . . 0.0 111.576 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -53.49 -29.48 36.35 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.155 0.582 . . . . 0.0 112.433 173.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -39.95 70.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.906 0.882 . . . . 0.0 112.945 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -65.48 -34.09 77.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.909 0.777 . . . . 0.0 112.177 170.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.26 -5.34 41.5 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.438 1.095 . . . . 0.0 113.882 172.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.393 0 C-N-CA 124.486 1.041 . . . . 0.0 114.933 176.759 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -114.97 139.12 50.09 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.583 1.153 . . . . 0.0 111.775 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.02 137.29 80.09 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.96 1.304 . . . . 0.0 112.204 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.06 -4.06 13.47 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 122.958 2.439 . . . . 0.0 114.138 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -127.54 -27.55 2.86 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.6 p -137.7 -171.08 2.91 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -85.02 -5.87 59.34 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.846 1.258 . . . . 0.0 114.308 -173.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -75.04 152.64 38.66 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 . . . . . 0 N--CA 1.469 0.482 0 C-N-CA 125.743 1.617 . . . . 0.0 113.154 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 110.548 -0.167 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -60.33 -43.65 96.22 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.79 -0.569 . . . . 0.0 110.779 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.5 ttp85 -58.9 -46.36 88.06 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.084 1.354 . . . . 0.0 112.845 171.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -60.49 -36.94 79.51 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.943 0.897 . . . . 0.0 112.451 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.2 mt -75.08 -49.06 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.089 0.956 . . . . 0.0 111.831 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -54.58 -28.48 46.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.862 0.865 . . . . 0.0 112.55 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.17 -37.55 75.22 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.821 0.848 . . . . 0.0 112.964 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -68.68 -33.83 74.63 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.452 -0.78 . . . . 0.0 112.138 171.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.0 -3.58 27.0 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.321 0 C-N-CA 124.766 1.175 . . . . 0.0 115.361 175.155 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.0 tmm? . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -111.98 131.1 55.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.892 1.277 . . . . 0.0 112.154 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.0 t -53.95 139.53 53.0 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.335 1.454 . . . . 0.0 112.87 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -73.32 -2.68 12.45 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.689 2.259 . . . . 0.0 114.036 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -124.86 -27.85 3.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.4 p -138.79 -174.9 3.96 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -83.09 -1.45 52.83 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.081 1.352 . . . . 0.0 114.545 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.26 146.36 43.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.396 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.1 tp . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -61.75 -42.71 99.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.134 0.573 . . . . 0.0 110.906 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.4 mtm180 -66.92 -41.56 86.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.909 0.884 . . . . 0.0 112.204 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -63.97 -38.04 89.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 112.678 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.1 mt -73.28 -48.09 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.004 -1.06 . . . . 0.0 111.309 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 15.4 m0 -51.5 -31.43 23.8 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.277 0.631 . . . . 0.0 112.608 172.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.31 -38.92 71.7 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.502 0.721 . . . . 0.0 112.86 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.7 -33.34 75.41 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.57 -0.706 . . . . 0.0 112.279 170.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -73.89 -2.58 24.44 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.546 1.138 . . . . 0.0 113.781 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.51 0 C-N-CA 124.916 1.246 . . . . 0.0 115.149 176.209 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.521 0 CA-C-O 119.447 -0.311 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -115.32 138.13 51.3 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.714 1.205 . . . . 0.0 112.288 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 40.7 t -57.33 137.5 81.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.237 1.415 . . . . 0.0 112.522 -173.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.85 -4.46 14.12 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 122.987 2.458 . . . . 0.0 114.061 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -128.56 -26.84 2.69 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -135.45 -174.44 3.63 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.26 -4.46 57.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.884 1.273 . . . . 0.0 113.961 -174.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -81.98 153.56 26.17 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 N--CA 1.473 0.683 0 C-N-CA 125.591 1.557 . . . . 0.0 114.022 -177.37 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 49.3 tp . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.62 -44.69 93.35 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.556 -0.715 . . . . 0.0 111.462 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -69.13 -32.54 71.99 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.29 -37.54 87.65 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.974 0.806 . . . . 0.0 111.79 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.91 -49.43 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.353 -0.842 . . . . 0.0 111.811 176.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.5 m0 -54.31 -29.4 47.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.328 0.651 . . . . 0.0 112.644 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.39 -37.98 77.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.033 0.933 . . . . 0.0 113.047 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -67.88 -32.55 73.11 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.414 -0.804 . . . . 0.0 112.165 171.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.93 -0.52 16.38 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.361 1.064 . . . . 0.0 113.712 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.464 0 C-N-CA 125.0 1.286 . . . . 0.0 115.377 175.205 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -113.19 141.03 47.43 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.229 1.012 . . . . 0.0 111.355 171.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 44.4 t -55.05 139.57 63.72 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.552 1.541 . . . . 0.0 112.573 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -71.21 -4.88 15.81 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.046 2.497 . . . . 0.0 114.03 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -126.4 -25.84 3.41 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.0 p -135.48 -166.97 1.93 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.241 1.016 . . . . 0.0 113.302 177.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -104.91 16.25 26.29 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.209 1.403 . . . . 0.0 113.461 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -78.55 146.35 34.31 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.851 0.861 . . . . 0.0 111.973 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 124.794 1.238 . . . . 0.0 113.955 -176.163 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 47.0 tp . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 110.8 -0.074 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.92 -34.51 77.61 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.174 -0.954 . . . . 0.0 112.125 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -64.65 -47.21 79.33 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.916 1.287 . . . . 0.0 112.098 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -57.84 -37.16 73.37 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.414 0.686 . . . . 0.0 112.21 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 80.0 mt -73.76 -48.82 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.012 0.925 . . . . 0.0 112.061 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.3 m0 -53.83 -28.16 33.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.608 0.763 . . . . 0.0 112.846 174.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.87 74.71 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.505 0.722 . . . . 0.0 112.841 175.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -71.32 -34.02 70.2 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.454 0.702 . . . . 0.0 112.216 171.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.73 -5.74 36.16 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 170.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.223 0 C-N-CA 124.618 1.104 . . . . 0.0 114.935 175.214 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.69 132.7 54.43 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.302 1.041 . . . . 0.0 112.169 172.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -55.8 137.27 71.81 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.385 1.074 . . . . 0.0 111.729 -178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -72.16 -2.84 12.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.792 2.328 . . . . 0.0 114.217 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -127.22 -25.83 3.18 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.3 p -136.06 179.65 6.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.38 -3.28 49.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -173.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -80.15 151.23 29.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -171.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.585 1.554 . . . . 0.0 115.01 -175.023 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 119.778 -0.154 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -58.23 -43.77 87.94 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.857 -0.527 . . . . 0.0 111.092 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -66.4 -39.57 89.11 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.142 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -61.93 -37.13 83.54 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.315 1.046 . . . . 0.0 112.317 173.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.9 mt -72.1 -47.6 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 O-C-N 121.04 -1.037 . . . . 0.0 111.36 174.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -56.45 -25.81 51.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.533 0.733 . . . . 0.0 112.67 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.27 -37.88 66.12 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.122 -0.986 . . . . 0.0 112.775 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -67.96 -33.89 75.52 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.548 -0.72 . . . . 0.0 112.037 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -72.52 -4.72 32.28 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.98 1.312 . . . . 0.0 114.037 170.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.386 0 C-N-CA 124.413 1.006 . . . . 0.0 114.936 175.599 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 118.605 -0.712 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -113.97 131.56 56.29 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.024 1.33 . . . . 0.0 112.583 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -55.79 140.29 68.19 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.351 1.46 . . . . 0.0 112.861 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -74.36 -3.65 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.828 2.352 . . . . 0.0 114.098 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -124.99 -28.69 3.43 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -135.89 -177.22 4.59 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.242 1.017 . . . . 0.0 113.693 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -81.74 -0.67 44.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.997 1.319 . . . . 0.0 114.446 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -75.08 149.92 39.0 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 125.361 1.464 . . . . 0.0 114.595 -176.306 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.5 tp . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -60.94 -32.39 71.9 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.269 -0.894 . . . . 0.0 112.123 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -68.34 -41.88 80.11 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.189 0.995 . . . . 0.0 112.556 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -64.09 -34.87 79.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.745 0.818 . . . . 0.0 112.032 174.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.1 mt -72.62 -48.66 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 121.221 -0.924 . . . . 0.0 111.638 175.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -53.75 -28.41 34.36 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 112.852 173.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.46 -37.84 74.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.484 0.714 . . . . 0.0 112.681 175.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -69.8 -34.05 73.19 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.438 0.695 . . . . 0.0 112.267 171.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -72.5 -4.77 32.47 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.407 0 C-N-CA 124.595 1.093 . . . . 0.0 115.063 175.065 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -113.37 135.24 54.08 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.793 1.637 . . . . 0.0 111.416 176.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.7 t -56.68 141.1 74.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.571 1.548 . . . . 0.0 113.032 -169.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -73.04 -3.32 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.517 2.145 . . . . 0.0 113.94 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -126.28 -25.71 3.46 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.2 p -138.5 -177.01 4.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.458 1.103 . . . . 0.0 113.519 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -81.27 -6.14 58.55 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -81.7 151.53 27.48 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 N--CA 1.471 0.599 0 C-N-CA 125.299 1.44 . . . . 0.0 113.788 -179.129 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 50.7 tp . . . . . 0 CA--C 1.538 0.489 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -58.4 -45.55 88.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.845 0.858 . . . . 0.0 111.469 -178.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -68.64 -31.65 70.94 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -68.66 -37.18 79.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.595 0.758 . . . . 0.0 112.555 173.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -72.36 -47.09 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 O-C-N 121.021 -1.049 . . . . 0.0 111.221 175.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -52.7 -30.31 31.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.377 0.671 . . . . 0.0 112.655 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.99 68.17 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 176.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -65.76 -34.08 77.35 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.873 0.76 . . . . 0.0 112.079 170.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -73.73 -0.39 15.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.929 1.292 . . . . 0.0 113.895 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.384 0 C-N-CA 125.083 1.325 . . . . 0.0 115.368 174.991 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.814 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -96.07 129.07 43.45 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.39 0.995 . . . . 0.0 111.473 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.7 t -52.8 137.33 44.7 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.947 0.899 . . . . 0.0 111.744 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -70.56 -2.91 11.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.915 2.41 . . . . 0.0 114.226 -178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -126.62 -25.17 3.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.9 p -140.14 -179.3 5.9 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.83 1.37 50.05 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -173.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -76.83 139.85 40.46 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.248 -0.908 . . . . 0.0 113.149 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 . . . . . 0 N--CA 1.468 0.451 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.426 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 120.589 0.233 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -61.02 -43.87 98.25 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 111.537 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -62.01 -33.84 75.09 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.941 0.896 . . . . 0.0 113.357 176.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -73.2 -36.67 66.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.152 0.981 . . . . 0.0 111.962 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.64 -48.46 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 121.283 -0.885 . . . . 0.0 111.553 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -54.39 -27.78 38.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.924 0.889 . . . . 0.0 112.644 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.39 -39.5 67.94 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 174.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.63 -34.47 77.94 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.701 0.682 . . . . 0.0 112.092 171.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.11 -7.28 51.98 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.388 1.075 . . . . 0.0 113.748 172.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 C-N-CA 124.536 1.065 . . . . 0.0 114.847 177.261 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? . . . . . 0 CA--C 1.537 0.481 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.717 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -108.93 131.72 54.77 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.509 1.124 . . . . 0.0 111.952 171.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.1 t -54.51 138.38 60.27 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.519 1.127 . . . . 0.0 112.011 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.33 -2.77 12.21 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.913 2.409 . . . . 0.0 114.151 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -124.86 -28.0 3.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.1 -179.47 5.8 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -87.95 7.92 28.77 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.094 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -78.24 141.62 38.45 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.127 -0.983 . . . . 0.0 112.829 175.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 . . . . . 0 CA--C 1.536 0.412 0 C-N-CA 125.468 1.507 . . . . 0.0 114.068 179.38 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -65.31 -43.63 90.45 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.64 -0.663 . . . . 0.0 111.279 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.4 mtm-85 -61.16 -43.51 98.77 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 118.807 0.73 . . . . 0.0 112.158 171.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -60.31 -37.6 81.09 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.343 0.657 . . . . 0.0 112.372 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.1 mt -74.4 -49.3 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.033 0.933 . . . . 0.0 111.786 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -54.01 -30.14 46.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 112.388 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.8 78.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.314 1.045 . . . . 0.0 113.134 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -67.88 -32.0 72.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.943 0.792 . . . . 0.0 112.075 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.5 0.76 13.71 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.327 1.051 . . . . 0.0 113.705 169.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.348 0 C-N-CA 125.119 1.342 . . . . 0.0 115.467 175.282 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 CA--C 1.54 0.587 0 CA-C-O 118.597 -0.715 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -98.51 128.55 44.9 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.513 1.051 . . . . 0.0 111.917 175.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.4 t -53.84 139.51 51.95 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 124.483 1.113 . . . . 0.0 112.24 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -72.67 -2.42 11.83 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 122.732 2.288 . . . . 0.0 114.214 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -125.37 -26.48 3.6 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.8 p -138.77 177.36 7.94 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -83.6 0.88 44.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -174.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -80.47 145.28 31.98 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.255 -0.903 . . . . 0.0 113.285 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 125.149 1.38 . . . . 0.0 114.6 -178.478 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.7 tp . . . . . 0 CA--C 1.537 0.444 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -59.33 -46.1 89.54 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.908 -0.495 . . . . 0.0 111.784 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.0 mtm-85 -64.31 -41.08 97.0 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.234 0.614 . . . . 0.0 112.237 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -62.24 -37.75 86.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.716 0.806 . . . . 0.0 112.61 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.4 mt -73.39 -48.46 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 O-C-N 121.098 -1.001 . . . . 0.0 111.596 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 30.2 m0 -54.25 -28.89 44.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.531 0.732 . . . . 0.0 112.374 174.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.22 -39.3 71.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.813 0.845 . . . . 0.0 113.03 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -66.1 -34.41 77.99 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.444 -0.785 . . . . 0.0 112.085 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.67 -4.42 34.24 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 171.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.482 0 C-N-CA 124.648 1.118 . . . . 0.0 115.057 176.383 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 118.92 -0.562 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -95.99 127.83 42.35 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.363 0.983 . . . . 0.0 111.752 174.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.3 t -51.96 138.19 35.03 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.37 1.068 . . . . 0.0 111.912 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -73.03 -1.35 10.39 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.405 2.07 . . . . 0.0 114.065 -178.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -125.77 -23.96 3.91 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.887 1.275 . . . . 0.0 114.342 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -142.17 -177.27 5.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -85.51 3.92 38.19 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -177.032 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -79.66 141.68 36.24 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.176 -0.952 . . . . 0.0 113.002 -178.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -178.263 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.9 tp . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 119.907 -0.092 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -61.0 -41.54 96.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.525 0.73 . . . . 0.0 111.376 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -62.27 -42.89 99.73 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.085 0.954 . . . . 0.0 112.328 172.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -65.13 -36.02 82.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.281 1.032 . . . . 0.0 112.713 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.1 mt -71.8 -47.07 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 O-C-N 120.814 -1.179 . . . . 0.0 111.625 175.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.4 m0 -54.56 -27.8 41.35 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.555 0.742 . . . . 0.0 112.689 171.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.91 -38.82 64.21 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.487 -0.758 . . . . 0.0 112.813 175.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -64.88 -37.17 86.74 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 118.822 0.737 . . . . 0.0 112.008 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -74.5 -4.25 35.67 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 114.278 173.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.479 0 C-N-CA 124.37 0.985 . . . . 0.0 114.725 175.981 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 119.384 -0.341 . . . . 0.0 110.978 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -114.28 137.3 51.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.547 1.539 . . . . 0.0 111.29 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -57.13 138.73 79.88 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 125.765 1.626 . . . . 0.0 112.383 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.37 -2.89 12.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 122.493 2.128 . . . . 0.0 113.83 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -126.43 -26.52 3.29 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.4 p -138.57 -171.69 3.12 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -79.04 -14.91 58.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.111 1.364 . . . . 0.0 113.87 -176.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -73.88 155.84 38.31 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 125.681 1.592 . . . . 0.0 113.916 -178.099 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -60.79 -43.44 98.1 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.611 -0.681 . . . . 0.0 111.804 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -69.97 -32.21 70.31 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -66.37 -37.37 85.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.767 0.827 . . . . 0.0 111.992 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.25 -47.31 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 O-C-N 121.1 -1.0 . . . . 0.0 111.552 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -54.21 -27.78 36.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.609 0.764 . . . . 0.0 112.902 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.29 -38.03 68.85 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.556 -0.715 . . . . 0.0 112.795 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -67.47 -35.22 78.75 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.591 -0.693 . . . . 0.0 112.075 171.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -73.84 -3.35 28.17 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.82 1.248 . . . . 0.0 114.131 171.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.378 0 C-N-CA 124.487 1.042 . . . . 0.0 114.915 174.735 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.0 tttt -112.91 140.22 47.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.364 1.066 . . . . 0.0 111.341 170.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 37.4 t -58.31 137.69 84.98 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.735 1.214 . . . . 0.0 111.578 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -72.28 -3.37 13.21 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 122.999 2.466 . . . . 0.0 114.199 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -126.42 -27.33 3.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.2 p -135.57 -179.3 5.56 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -78.25 -2.41 37.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.866 1.267 . . . . 0.0 114.025 -175.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -83.77 154.11 23.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -170.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 . . . . . 0 N--CA 1.472 0.648 0 C-N-CA 126.026 1.73 . . . . 0.0 113.113 -178.735 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -56.21 -40.78 74.58 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.865 -0.522 . . . . 0.0 111.98 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -66.19 -43.68 86.15 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.108 0.963 . . . . 0.0 111.411 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.77 -36.98 82.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.032 0.933 . . . . 0.0 112.32 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.7 mt -75.18 -49.39 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 O-C-N 121.313 -0.867 . . . . 0.0 111.783 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -55.5 -27.65 49.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.325 0.65 . . . . 0.0 112.478 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.17 73.16 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.717 0.807 . . . . 0.0 112.923 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.77 -33.69 76.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.943 0.792 . . . . 0.0 112.173 171.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.18 -3.28 28.82 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.518 0 C-N-CA 124.694 1.14 . . . . 0.0 115.104 175.482 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -109.91 130.56 55.51 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.938 1.295 . . . . 0.0 112.717 174.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -54.97 140.06 62.07 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.336 1.455 . . . . 0.0 112.599 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -75.34 -3.53 14.02 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.865 2.377 . . . . 0.0 114.135 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -123.84 -29.37 3.69 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.3 p -134.13 -178.47 5.05 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.47 -16.77 59.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.497 1.119 . . . . 0.0 113.915 -175.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.55 150.79 45.73 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -168.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 . . . . . 0 N--CA 1.47 0.536 0 C-N-CA 125.609 1.564 . . . . 0.0 115.189 -176.741 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.0 tp . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 120.69 0.281 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.32 -29.28 68.76 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.403 -0.81 . . . . 0.0 112.379 -178.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -56.36 -45.63 80.39 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.172 1.389 . . . . 0.0 112.446 171.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -74.73 -32.47 62.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.066 1.347 . . . . 0.0 112.343 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.6 mt -72.13 -47.76 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.253 -0.905 . . . . 0.0 111.42 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -52.66 -29.08 24.39 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 112.94 172.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.41 73.03 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.52 0.728 . . . . 0.0 112.556 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -70.69 -32.91 70.32 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.582 0.753 . . . . 0.0 112.401 171.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.3 -3.44 23.79 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.32 0 C-N-CA 124.759 1.171 . . . . 0.0 115.317 174.207 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 119.754 -0.165 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -116.98 139.69 50.36 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.82 1.248 . . . . 0.0 111.504 172.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 41.9 t -56.96 137.35 79.67 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.874 1.27 . . . . 0.0 111.993 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -69.83 -3.68 12.54 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.086 2.524 . . . . 0.0 114.045 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.48 -28.9 2.73 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.7 p -136.75 -173.72 3.51 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -82.79 -5.07 58.76 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.807 1.243 . . . . 0.0 114.272 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -78.96 150.87 31.92 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -174.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 . . . . . 0 N--CA 1.469 0.522 0 C-N-CA 125.96 1.704 . . . . 0.0 113.157 179.796 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.7 tp . . . . . 0 N--CA 1.468 0.458 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -60.94 -41.01 95.45 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.8 . . . . 0.0 111.532 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -58.99 -50.8 72.7 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.126 0.97 . . . . 0.0 112.011 169.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -58.12 -37.51 74.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.389 1.076 . . . . 0.0 112.584 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.8 mt -74.4 -50.0 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 124.083 0.953 . . . . 0.0 111.796 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.7 m0 -51.55 -32.75 29.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.231 0.612 . . . . 0.0 112.598 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.17 84.83 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.241 1.017 . . . . 0.0 112.918 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -71.74 -29.54 64.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.503 0.721 . . . . 0.0 112.631 171.147 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.04 -4.03 39.09 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 173.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.316 0 O-C-N 121.241 -0.912 . . . . 0.0 113.74 178.053 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m -64.81 -22.21 66.94 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.9 p -81.52 -14.83 56.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.642 1.577 . . . . 0.0 114.235 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.89 146.33 4.58 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.41 1.481 . . . . 0.0 112.691 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.0 69.92 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -171.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.1 p -107.87 -0.83 21.27 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.033 1.733 . . . . 0.0 114.209 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.02 -136.14 48.64 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.206 0.908 . . . . 0.0 113.064 -175.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 52.35 43.55 30.72 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.469 1.908 . . . . 0.0 114.346 172.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.14 165.62 19.98 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.085 0.954 . . . . 0.0 112.558 172.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.46 152.55 36.11 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.537 0.735 . . . . 0.0 110.276 171.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -116.37 138.16 51.56 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.479 1.111 . . . . 0.0 112.567 176.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -57.07 139.53 78.9 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 126.006 1.722 . . . . 0.0 112.611 -173.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -72.3 -2.72 12.11 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.565 2.177 . . . . 0.0 114.01 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -126.38 -28.24 3.09 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.8 p -139.6 -171.39 3.13 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -175.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -82.27 -3.45 55.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.432 1.493 . . . . 0.0 114.038 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -82.66 154.97 24.63 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -171.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -119.76 150.11 40.93 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.602 1.561 . . . . 0.0 114.253 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -141.45 167.73 21.47 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.251 1.42 . . . . 0.0 112.239 170.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.45 140.92 58.65 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.548 -0.72 . . . . 0.0 109.664 168.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -56.96 -20.15 22.11 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -169.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -124.89 16.77 8.61 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.996 1.718 . . . . 0.0 113.016 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -70.9 134.56 23.7 Favored Glycine 0 CA--C 1.535 1.306 0 O-C-N 120.94 -1.1 . . . . 0.0 113.102 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 t -71.47 -31.11 66.76 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 121.847 -0.796 . . . . 0.0 112.864 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -62.48 -24.64 67.57 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.308 1.043 . . . . 0.0 113.241 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.0 tp -60.2 -38.12 82.32 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.863 0.865 . . . . 0.0 112.032 172.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.3 mm100 -64.28 -43.85 93.51 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.676 -0.64 . . . . 0.0 110.602 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -64.45 -41.7 96.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.917 0.887 . . . . 0.0 112.255 173.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -61.82 -37.47 84.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.638 0.775 . . . . 0.0 112.549 176.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.5 mt -73.68 -47.98 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.148 -0.97 . . . . 0.0 111.548 175.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.4 m0 -55.63 -27.44 49.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -39.09 73.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.08 0.952 . . . . 0.0 112.862 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -67.35 -33.91 76.21 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.168 171.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -73.14 -0.98 15.71 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.941 1.297 . . . . 0.0 113.938 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.03 15.56 80.36 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.777 1.179 . . . . 0.0 115.477 173.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.9 t -71.08 135.24 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-N 118.761 1.28 . . . . 0.0 110.139 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.019 1.328 . . . . 0.0 113.065 -177.94 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.8 m -136.02 151.26 49.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.274 1.43 . . . . 0.0 111.992 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.5 m -70.01 144.88 52.13 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.383 1.073 . . . . 0.0 112.855 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 161.81 -169.43 37.24 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.624 1.107 . . . . 0.0 113.742 178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 m -69.92 -3.16 14.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.138 1.375 . . . . 0.0 114.491 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.8 p -74.93 -5.97 46.69 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.532 1.933 . . . . 0.0 114.62 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -54.95 124.51 32.7 Favored Glycine 0 CA--C 1.537 1.439 0 C-N-CA 124.336 0.97 . . . . 0.0 113.085 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 55.88 18.2 2.89 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.944 2.097 . . . . 0.0 115.901 -174.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.41 176.94 5.01 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.043 1.337 . . . . 0.0 111.837 169.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.67 152.36 26.61 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.162 1.385 . . . . 0.0 110.365 169.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -115.02 137.5 51.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.816 1.246 . . . . 0.0 111.741 174.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.03 138.15 83.76 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.801 1.24 . . . . 0.0 112.324 -176.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -71.35 -3.92 13.93 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.016 2.477 . . . . 0.0 114.113 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -126.61 -28.74 2.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.5 p -133.81 179.63 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -177.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.25 -4.2 54.81 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -83.86 158.56 21.6 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -119.21 153.35 35.1 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.917 1.687 . . . . 0.0 113.166 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -128.91 144.55 51.21 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.937 1.295 . . . . 0.0 109.776 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.0 ptm -84.48 -10.47 57.45 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -135.77 162.13 33.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.061 2.144 . . . . 0.0 110.82 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -105.27 20.14 19.38 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.912 1.685 . . . . 0.0 113.894 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -71.95 -177.09 28.13 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.957 1.265 . . . . 0.0 114.988 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 m -59.25 -25.45 64.07 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -172.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -62.12 -36.57 82.17 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.288 -0.883 . . . . 0.0 112.441 175.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -69.17 -40.12 78.34 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.301 0.64 . . . . 0.0 111.1 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -61.26 -41.21 96.52 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.596 -0.69 . . . . 0.0 111.224 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.28 -41.41 85.49 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.515 0.726 . . . . 0.0 112.213 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -59.66 -37.36 78.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.693 0.797 . . . . 0.0 112.429 174.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -73.52 -49.46 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 O-C-N 121.327 -0.858 . . . . 0.0 111.59 176.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -50.88 -32.69 21.29 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.743 0.817 . . . . 0.0 112.531 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.47 -34.34 74.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.018 0.927 . . . . 0.0 113.274 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.3 -29.8 67.73 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.452 -0.78 . . . . 0.0 112.113 171.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.67 1.43 17.05 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.607 1.163 . . . . 0.0 113.304 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.11 4.16 90.33 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.644 1.593 . . . . 0.0 115.382 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 40.6 t -80.64 140.39 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.282 1.433 . . . . 0.0 110.262 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? . . . . . 0 C--O 1.25 1.123 0 C-N-CA 125.093 1.357 . . . . 0.0 112.262 -172.88 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 110.854 -0.898 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 p -79.8 143.9 34.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.505 1.122 . . . . 0.0 113.609 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -66.25 168.43 8.68 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.532 1.933 . . . . 0.0 114.034 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.15 26.63 73.37 Favored Glycine 0 CA--C 1.535 1.34 0 O-C-N 121.587 -0.696 . . . . 0.0 114.195 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.4 m 58.59 26.66 14.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.718 1.607 . . . . 0.0 114.622 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.8 m -71.52 -35.62 70.78 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.28 -0.887 . . . . 0.0 111.375 169.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.63 125.31 6.9 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 168.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -128.24 19.66 6.37 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.79 1.236 . . . . 0.0 114.272 -171.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.07 166.61 17.75 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.454 1.102 . . . . 0.0 112.274 169.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.86 154.55 39.42 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.101 0.56 . . . . 0.0 110.587 172.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -117.5 136.3 53.33 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.844 1.258 . . . . 0.0 112.032 176.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.26 140.83 78.35 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.046 1.738 . . . . 0.0 113.224 -170.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.6 -3.52 13.63 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.687 2.258 . . . . 0.0 114.203 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -125.55 -28.06 3.35 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.9 p -138.06 -172.94 3.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.06 -2.29 56.42 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -78.96 153.97 29.95 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -173.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -116.12 149.28 39.25 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.431 1.492 . . . . 0.0 114.191 -176.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.49 157.73 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.768 1.227 . . . . 0.0 113.091 170.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.2 ppp? -99.82 -178.47 3.87 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.655 1.582 . . . . 0.0 112.119 171.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -65.81 9.5 0.13 Allowed 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 118.384 2.735 . . . . 0.0 118.384 -168.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -64.66 -37.61 88.17 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 119.97 1.259 . . . . 0.0 112.072 172.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.79 -41.86 1.26 Allowed Glycine 0 CA--C 1.535 1.336 0 C-N-CA 125.921 1.724 . . . . 0.0 117.063 169.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.9 p -67.57 -32.48 73.26 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.853 1.826 . . . . 0.0 113.214 -177.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -70.17 -41.87 73.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.488 1.515 . . . . 0.0 112.648 171.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.08 -43.91 97.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.003 0.921 . . . . 0.0 111.771 171.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -57.82 -46.6 84.46 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.177 0.591 . . . . 0.0 111.109 176.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -62.73 -42.36 99.62 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.436 0.694 . . . . 0.0 112.614 174.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -62.42 -36.98 84.06 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 112.697 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.4 mt -73.8 -48.71 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 O-C-N 121.053 -1.029 . . . . 0.0 111.401 176.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -54.08 -30.29 47.68 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.397 0.679 . . . . 0.0 112.217 174.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -37.96 76.24 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.18 0.992 . . . . 0.0 113.109 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -67.01 -32.96 74.54 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.942 0.792 . . . . 0.0 112.141 170.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -73.96 0.47 13.41 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.428 1.091 . . . . 0.0 113.821 169.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.62 11.46 84.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.978 1.275 . . . . 0.0 115.482 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.56 137.12 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.721 1.208 . . . . 0.0 110.277 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.811 1.645 . . . . 0.0 111.421 -178.738 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 60.4 p -74.08 157.62 35.73 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.574 1.149 . . . . 0.0 113.039 176.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.2 t -152.57 162.61 40.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.958 1.303 . . . . 0.0 111.905 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.86 176.79 46.36 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.216 1.389 . . . . 0.0 115.128 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.2 m -68.49 152.14 45.81 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.841 1.256 . . . . 0.0 113.101 -178.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 20.8 m 54.69 33.91 20.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.53 1.532 . . . . 0.0 114.576 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.15 12.24 5.62 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.664 1.602 . . . . 0.0 116.591 -174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -66.33 148.49 51.78 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 118.973 1.387 . . . . 0.0 112.672 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -149.31 174.06 12.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.548 1.539 . . . . 0.0 112.223 -168.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.43 148.48 41.08 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.512 -0.742 . . . . 0.0 110.588 173.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -105.66 137.17 43.96 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.28 1.432 . . . . 0.0 112.484 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -55.63 134.69 71.53 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.234 1.414 . . . . 0.0 112.422 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.44 -4.08 14.6 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.1 2.533 . . . . 0.0 114.108 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -120.91 -30.2 4.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . 0.25 16.1 p -125.69 -132.34 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.274 1.03 . . . . 0.0 112.651 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -139.14 11.23 2.59 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.328 1.851 . . . . 0.0 112.98 -175.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -81.99 149.5 28.11 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.139 -0.976 . . . . 0.0 112.301 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -112.26 146.52 38.04 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -138.38 152.02 48.03 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.953 1.301 . . . . 0.0 112.901 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 96.6 mmm -84.18 -172.56 4.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.963 1.305 . . . . 0.0 111.576 170.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -65.91 -2.84 4.26 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -76.2 65.52 2.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.529 1.532 . . . . 0.0 111.201 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.58 -18.64 59.22 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.12 1.343 . . . . 0.0 115.681 -170.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -58.79 -32.92 69.76 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 118.82 1.31 . . . . 0.0 113.338 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -88.56 -27.92 21.08 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 176.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.87 -37.86 88.57 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.537 -0.727 . . . . 0.0 111.375 170.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -57.03 -43.81 82.28 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.653 -0.654 . . . . 0.0 111.243 172.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -63.15 -43.78 97.33 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.032 0.833 . . . . 0.0 112.322 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -61.08 -38.57 86.74 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.606 0.763 . . . . 0.0 112.589 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.8 mt -74.39 -48.91 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.207 -0.933 . . . . 0.0 111.782 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.9 m0 -52.9 -30.94 37.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.599 0.759 . . . . 0.0 112.555 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.57 -37.28 76.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.113 0.965 . . . . 0.0 113.064 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -68.15 -31.6 71.28 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.502 -0.749 . . . . 0.0 112.13 171.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -74.72 0.36 15.52 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.317 1.047 . . . . 0.0 113.672 169.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.37 12.78 83.48 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.217 1.389 . . . . 0.0 115.375 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.2 t -79.19 136.79 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 C-N-CA 126.078 1.751 . . . . 0.0 111.741 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 60.9 m -90.11 -9.51 48.08 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -177.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.3 m -67.52 150.27 49.07 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.918 1.287 . . . . 0.0 113.02 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.99 144.76 43.76 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 123.758 0.694 . . . . 0.0 113.379 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.2 m -111.61 12.44 21.23 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.12 1.368 . . . . 0.0 113.861 -176.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.7 p -147.06 168.96 20.25 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.673 1.589 . . . . 0.0 112.507 -177.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.79 69.38 1.52 Allowed Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.609 1.576 . . . . 0.0 113.973 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -81.88 -9.75 59.5 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.874 1.67 . . . . 0.0 114.209 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -139.34 166.29 24.95 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.491 1.916 . . . . 0.0 111.5 174.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 156.36 24.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.175 0.99 . . . . 0.0 110.69 172.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -116.59 138.26 51.56 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.592 1.157 . . . . 0.0 112.623 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.97 139.05 78.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.787 1.635 . . . . 0.0 112.556 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -71.66 -3.49 13.2 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.811 2.34 . . . . 0.0 113.702 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -126.83 -28.16 2.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.25 -172.68 3.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -176.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.29 -3.72 55.81 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.229 1.412 . . . . 0.0 114.054 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -82.99 155.4 23.98 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -171.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -118.88 149.21 41.95 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.619 1.568 . . . . 0.0 113.905 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -139.38 159.39 42.26 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.758 1.223 . . . . 0.0 112.431 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 92.3 mmm -78.56 160.96 27.34 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.999 0.92 . . . . 0.0 112.199 173.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -61.52 -13.2 19.28 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.365 1.987 . . . . 0.0 116.365 -170.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -64.28 -34.56 78.4 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.416 1.086 . . . . 0.0 112.506 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.36 -0.3 33.64 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 117.49 1.756 . . . . 0.0 117.49 169.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -60.3 -40.16 89.53 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.608 1.704 . . . . 0.0 114.14 -169.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -94.16 -19.7 20.54 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.817 0.847 . . . . 0.0 112.898 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 tp -61.91 -40.04 94.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.997 0.919 . . . . 0.0 111.597 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -55.61 -45.09 77.56 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 118.324 0.511 . . . . 0.0 111.266 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -66.77 -43.21 84.63 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.718 1.207 . . . . 0.0 112.053 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -60.34 -38.46 83.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.681 1.192 . . . . 0.0 112.66 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.4 mt -74.68 -48.52 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 121.075 -1.015 . . . . 0.0 111.576 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -53.49 -29.48 36.35 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.155 0.582 . . . . 0.0 112.433 173.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -39.95 70.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.906 0.882 . . . . 0.0 112.945 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -65.48 -34.09 77.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.909 0.777 . . . . 0.0 112.177 170.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.26 -5.34 41.5 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.438 1.095 . . . . 0.0 113.882 172.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.45 23.38 75.63 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.486 1.041 . . . . 0.0 114.933 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.12 138.36 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.803 1.241 . . . . 0.0 110.866 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 99.5 mttt . . . . . 0 C--O 1.252 1.231 0 C-N-CA 126.34 1.856 . . . . 0.0 111.591 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.0 p -74.78 158.38 33.59 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.699 1.199 . . . . 0.0 113.158 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.7 t -149.29 152.0 35.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 111.492 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.02 -41.39 1.27 Allowed Glycine 0 CA--C 1.539 1.552 0 C-N-CA 125.974 1.75 . . . . 0.0 114.985 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.8 t -152.67 151.71 30.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.867 1.667 . . . . 0.0 111.691 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.8 p -86.14 -10.02 55.58 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.115 1.366 . . . . 0.0 113.387 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.93 178.61 48.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.093 1.33 . . . . 0.0 114.352 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 86.7 mtm180 -131.5 156.8 45.04 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.894 1.678 . . . . 0.0 112.0 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.07 168.63 20.47 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.135 1.774 . . . . 0.0 111.236 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.93 149.19 29.51 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.407 0.683 . . . . 0.0 110.082 169.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -114.97 139.12 50.09 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.583 1.153 . . . . 0.0 111.775 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.02 137.29 80.09 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.96 1.304 . . . . 0.0 112.204 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.06 -4.06 13.47 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 122.958 2.439 . . . . 0.0 114.138 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -127.54 -27.55 2.86 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.6 p -137.7 -171.08 2.91 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -85.02 -5.87 59.34 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.846 1.258 . . . . 0.0 114.308 -173.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -75.04 152.64 38.66 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -117.47 150.12 39.45 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.743 1.617 . . . . 0.0 113.154 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -133.34 144.79 49.86 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.985 1.314 . . . . 0.0 110.573 169.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.7 tpt -95.37 130.7 42.07 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.628 0.771 . . . . 0.0 110.17 169.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 57.24 171.27 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.64 1.976 . . . . 0.0 114.129 -169.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -80.03 155.0 27.8 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.422 1.089 . . . . 0.0 111.806 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.25 163.91 29.54 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 123.647 0.641 . . . . 0.0 114.025 176.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -63.94 -25.19 68.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -72.41 -28.68 63.13 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.353 -0.842 . . . . 0.0 112.63 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp -71.4 -40.6 70.4 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.634 -0.666 . . . . 0.0 110.548 168.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -60.33 -43.65 96.22 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.79 -0.569 . . . . 0.0 110.779 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.5 ttp85 -58.9 -46.36 88.06 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.084 1.354 . . . . 0.0 112.845 171.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -60.49 -36.94 79.51 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.943 0.897 . . . . 0.0 112.451 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.2 mt -75.08 -49.06 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.089 0.956 . . . . 0.0 111.831 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -54.58 -28.48 46.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.862 0.865 . . . . 0.0 112.55 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.17 -37.55 75.22 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.821 0.848 . . . . 0.0 112.964 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -68.68 -33.83 74.63 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.452 -0.78 . . . . 0.0 112.138 171.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.0 -3.58 27.0 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.57 19.28 79.36 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 124.766 1.175 . . . . 0.0 115.361 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.9 t -68.62 142.57 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.586 1.554 . . . . 0.0 111.051 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.2 mttp . . . . . 0 C--O 1.255 1.356 0 C-N-CA 125.968 1.707 . . . . 0.0 112.009 -173.312 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m -74.05 -20.33 60.33 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -173.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 52.8 m -137.23 144.14 42.64 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.616 1.567 . . . . 0.0 111.67 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.35 164.6 47.68 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.334 0.968 . . . . 0.0 113.899 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.0 p -79.61 155.21 28.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.071 1.349 . . . . 0.0 112.485 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 44.5 m -76.23 140.74 41.77 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.072 0.949 . . . . 0.0 113.164 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 65.53 -162.3 41.32 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.57 1.081 . . . . 0.0 114.717 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mmm180 -83.83 58.32 4.59 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.215 1.406 . . . . 0.0 111.682 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.99 163.37 24.76 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.507 1.123 . . . . 0.0 113.512 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -113.88 137.62 51.42 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.446 2.298 . . . . 0.0 109.037 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -111.98 131.1 55.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.892 1.277 . . . . 0.0 112.154 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.0 t -53.95 139.53 53.0 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.335 1.454 . . . . 0.0 112.87 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -73.32 -2.68 12.45 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.689 2.259 . . . . 0.0 114.036 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -124.86 -27.85 3.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.4 p -138.79 -174.9 3.96 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -83.09 -1.45 52.83 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.081 1.352 . . . . 0.0 114.545 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.26 146.36 43.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.93 148.64 30.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -134.25 173.37 11.68 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.49 1.916 . . . . 0.0 110.743 170.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.8 ttp -140.45 148.09 40.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.764 1.225 . . . . 0.0 111.265 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt 51.5 29.53 5.46 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 126.401 1.881 . . . . 0.0 115.102 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.8 t30 49.48 45.44 23.96 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.094 1.757 . . . . 0.0 113.792 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.09 149.25 45.25 Favored Glycine 0 CA--C 1.537 1.451 0 C-N-CA 123.921 0.772 . . . . 0.0 113.474 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.8 p -64.05 -18.41 64.32 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -65.46 -23.51 66.94 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.084 -1.01 . . . . 0.0 113.129 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.1 tp -63.17 -40.67 98.23 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.324 0.966 . . . . 0.0 111.554 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -61.75 -42.71 99.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.134 0.573 . . . . 0.0 110.906 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.4 mtm180 -66.92 -41.56 86.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.909 0.884 . . . . 0.0 112.204 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -63.97 -38.04 89.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 112.678 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.1 mt -73.28 -48.09 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.004 -1.06 . . . . 0.0 111.309 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 15.4 m0 -51.5 -31.43 23.8 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.277 0.631 . . . . 0.0 112.608 172.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.31 -38.92 71.7 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.502 0.721 . . . . 0.0 112.86 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.7 -33.34 75.41 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.57 -0.706 . . . . 0.0 112.279 170.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -73.89 -2.58 24.44 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.546 1.138 . . . . 0.0 113.781 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.94 16.95 80.33 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.916 1.246 . . . . 0.0 115.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 41.1 t -73.92 135.18 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.995 1.318 . . . . 0.0 110.607 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 C--O 1.253 1.252 0 C-N-CA 126.431 1.893 . . . . 0.0 111.517 179.028 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 m -66.74 146.81 54.05 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.357 1.063 . . . . 0.0 112.864 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.5 t -135.4 -57.31 0.8 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.155 0.982 . . . . 0.0 113.203 -171.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 55.74 -148.88 26.22 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 124.241 0.924 . . . . 0.0 114.743 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.0 p -78.16 -22.77 48.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.4 p -85.41 -12.01 53.06 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.292 1.437 . . . . 0.0 113.792 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.85 5.44 74.87 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 125.424 1.487 . . . . 0.0 115.124 -177.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ptt-85 -159.97 150.96 19.21 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 118.852 1.326 . . . . 0.0 114.105 -170.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.19 170.41 16.16 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.951 0.9 . . . . 0.0 111.827 168.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.73 153.35 20.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.681 1.192 . . . . 0.0 110.755 171.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -115.32 138.13 51.3 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.714 1.205 . . . . 0.0 112.288 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 40.7 t -57.33 137.5 81.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.237 1.415 . . . . 0.0 112.522 -173.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.85 -4.46 14.12 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 122.987 2.458 . . . . 0.0 114.061 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -128.56 -26.84 2.69 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -135.45 -174.44 3.63 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.26 -4.46 57.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.884 1.273 . . . . 0.0 113.961 -174.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -81.98 153.56 26.17 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -116.15 147.76 41.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.591 1.557 . . . . 0.0 114.022 -177.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -140.77 160.18 40.6 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.675 1.59 . . . . 0.0 110.426 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.5 ttt -150.92 128.64 11.57 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.047 -1.033 . . . . 0.0 111.215 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . 0.287 62.9 pttt 47.98 27.27 1.15 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.835 2.054 . . . . 0.0 115.577 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -86.47 -11.06 52.86 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.883 1.273 . . . . 0.0 113.993 -177.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.39 -121.98 28.21 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.502 1.049 . . . . 0.0 113.66 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m -55.89 -25.69 43.9 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.09 1.356 . . . . 0.0 114.334 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.99 -31.77 69.63 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.463 -0.773 . . . . 0.0 112.69 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 49.3 tp -74.82 -39.25 61.75 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.735 -0.603 . . . . 0.0 110.584 169.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.62 -44.69 93.35 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.556 -0.715 . . . . 0.0 111.462 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -69.13 -32.54 71.99 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.29 -37.54 87.65 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.974 0.806 . . . . 0.0 111.79 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.91 -49.43 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.353 -0.842 . . . . 0.0 111.811 176.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.5 m0 -54.31 -29.4 47.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.328 0.651 . . . . 0.0 112.644 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.39 -37.98 77.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.033 0.933 . . . . 0.0 113.047 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -67.88 -32.55 73.11 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.414 -0.804 . . . . 0.0 112.165 171.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.93 -0.52 16.38 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.361 1.064 . . . . 0.0 113.712 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.66 13.81 82.76 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.0 1.286 . . . . 0.0 115.377 175.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -74.86 134.24 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 118.457 1.129 . . . . 0.0 110.478 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 126.234 1.814 . . . . 0.0 112.896 179.866 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 112.144 -0.383 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 m -68.41 153.2 44.22 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 113.226 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 87.9 p -144.73 166.29 25.62 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.63 1.572 . . . . 0.0 112.171 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.45 -149.04 39.75 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.015 0.817 . . . . 0.0 113.465 -176.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -62.63 146.58 51.71 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.722 1.209 . . . . 0.0 113.584 -176.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 t -78.6 168.69 19.4 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.474 1.11 . . . . 0.0 112.649 176.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.42 -160.87 51.24 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.909 1.242 . . . . 0.0 113.963 -177.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -131.81 161.57 32.61 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.994 1.718 . . . . 0.0 112.098 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.29 165.51 27.22 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.761 1.624 . . . . 0.0 112.366 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.4 150.99 28.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.354 1.062 . . . . 0.0 109.632 168.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -113.19 141.03 47.43 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.229 1.012 . . . . 0.0 111.355 171.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 44.4 t -55.05 139.57 63.72 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.552 1.541 . . . . 0.0 112.573 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -71.21 -4.88 15.81 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.046 2.497 . . . . 0.0 114.03 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -126.4 -25.84 3.41 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.0 p -135.48 -166.97 1.93 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.241 1.016 . . . . 0.0 113.302 177.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -104.91 16.25 26.29 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.209 1.403 . . . . 0.0 113.461 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -78.55 146.35 34.31 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.851 0.861 . . . . 0.0 111.973 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.35 147.56 38.95 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.794 1.238 . . . . 0.0 113.955 -176.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -131.48 135.75 47.36 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.898 1.279 . . . . 0.0 110.366 169.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -74.56 -33.36 62.69 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.439 -0.788 . . . . 0.0 112.091 176.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -108.95 156.93 19.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.17 1.788 . . . . 0.0 112.162 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -105.79 133.56 50.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.954 1.302 . . . . 0.0 109.367 169.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.36 -165.21 38.22 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.636 0.636 . . . . 0.0 114.148 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -60.9 -36.44 79.24 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -173.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.81 -31.47 69.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.089 -1.007 . . . . 0.0 112.439 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 47.0 tp -72.87 -40.28 65.78 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.551 0.74 . . . . 0.0 110.8 169.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.92 -34.51 77.61 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.174 -0.954 . . . . 0.0 112.125 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -64.65 -47.21 79.33 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.916 1.287 . . . . 0.0 112.098 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -57.84 -37.16 73.37 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.414 0.686 . . . . 0.0 112.21 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 80.0 mt -73.76 -48.82 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.012 0.925 . . . . 0.0 112.061 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.3 m0 -53.83 -28.16 33.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.608 0.763 . . . . 0.0 112.846 174.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.87 74.71 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.505 0.722 . . . . 0.0 112.841 175.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -71.32 -34.02 70.2 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.454 0.702 . . . . 0.0 112.216 171.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.73 -5.74 36.16 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 170.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.64 23.76 74.32 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.618 1.104 . . . . 0.0 114.935 175.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -64.74 137.69 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.873 1.269 . . . . 0.0 110.955 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm . . . . . 0 C--O 1.254 1.299 0 C-N-CA 125.367 1.467 . . . . 0.0 112.692 -175.699 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.137 -0.385 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.7 p -147.51 162.02 39.92 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.387 1.475 . . . . 0.0 112.553 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m -68.04 150.41 48.48 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.61 1.164 . . . . 0.0 113.035 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.88 -166.59 35.68 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.354 0.978 . . . . 0.0 113.646 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.9 m -73.91 8.18 2.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.56 1.544 . . . . 0.0 115.163 -174.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.5 m -65.69 -20.98 66.5 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.221 1.808 . . . . 0.0 114.563 -176.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -60.13 119.65 19.36 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.226 0.917 . . . . 0.0 112.789 -177.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 55.53 17.29 2.19 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.685 1.994 . . . . 0.0 115.167 -174.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.34 162.29 16.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.865 1.266 . . . . 0.0 112.686 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -74.66 134.52 41.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.016 1.327 . . . . 0.0 109.128 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.69 132.7 54.43 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.302 1.041 . . . . 0.0 112.169 172.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -55.8 137.27 71.81 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.385 1.074 . . . . 0.0 111.729 -178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -72.16 -2.84 12.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.792 2.328 . . . . 0.0 114.217 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -127.22 -25.83 3.18 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.3 p -136.06 179.65 6.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.38 -3.28 49.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -173.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -80.15 151.23 29.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -171.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -111.9 151.4 29.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.585 1.554 . . . . 0.0 115.01 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -133.74 148.36 51.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.997 1.719 . . . . 0.0 110.304 173.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.5 ptm -74.75 -32.21 62.02 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -148.91 161.51 41.72 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.069 2.148 . . . . 0.0 111.246 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -74.51 149.58 40.2 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.86 0.864 . . . . 0.0 110.493 168.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 172.33 179.52 43.24 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.577 1.084 . . . . 0.0 113.393 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.6 p -60.75 -29.52 69.44 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -71.15 -37.59 72.25 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.535 0.734 . . . . 0.0 112.394 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp -67.88 -42.92 80.49 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.264 0.625 . . . . 0.0 110.909 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -58.23 -43.77 87.94 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.857 -0.527 . . . . 0.0 111.092 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -66.4 -39.57 89.11 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.142 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -61.93 -37.13 83.54 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.315 1.046 . . . . 0.0 112.317 173.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.9 mt -72.1 -47.6 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 O-C-N 121.04 -1.037 . . . . 0.0 111.36 174.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -56.45 -25.81 51.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.533 0.733 . . . . 0.0 112.67 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.27 -37.88 66.12 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.122 -0.986 . . . . 0.0 112.775 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -67.96 -33.89 75.52 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.548 -0.72 . . . . 0.0 112.037 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -72.52 -4.72 32.28 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.98 1.312 . . . . 0.0 114.037 170.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.3 27.18 66.43 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.413 1.006 . . . . 0.0 114.936 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 44.6 t -79.39 134.19 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.14 1.376 . . . . 0.0 111.117 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 127.464 2.306 . . . . 0.0 112.163 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.1 p -62.69 -25.22 68.05 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.7 p -58.47 -26.31 63.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.954 1.302 . . . . 0.0 113.451 171.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.62 -15.56 73.37 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.427 1.013 . . . . 0.0 114.488 172.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.5 m -108.18 -39.7 5.4 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.147 1.379 . . . . 0.0 112.577 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 63.7 m -77.86 -20.12 53.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 177.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -60.0 123.43 33.09 Favored Glycine 0 CA--C 1.534 1.279 0 O-C-N 121.303 -0.873 . . . . 0.0 112.71 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 53.03 28.56 6.87 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 126.178 1.791 . . . . 0.0 114.312 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -139.92 171.54 14.06 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.702 1.601 . . . . 0.0 112.467 -177.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -108.08 138.82 43.68 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.874 1.67 . . . . 0.0 109.468 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -113.97 131.56 56.29 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.024 1.33 . . . . 0.0 112.583 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -55.79 140.29 68.19 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.351 1.46 . . . . 0.0 112.861 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -74.36 -3.65 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.828 2.352 . . . . 0.0 114.098 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -124.99 -28.69 3.43 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -135.89 -177.22 4.59 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.242 1.017 . . . . 0.0 113.693 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -81.74 -0.67 44.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.997 1.319 . . . . 0.0 114.446 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -75.08 149.92 39.0 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.04 151.16 29.66 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.361 1.464 . . . . 0.0 114.595 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -127.88 151.03 49.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.483 1.513 . . . . 0.0 112.557 173.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 ptm -140.11 26.67 2.21 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.21 2.204 . . . . 0.0 111.784 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -131.44 172.66 11.93 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.18 2.192 . . . . 0.0 111.927 -169.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -59.94 148.51 34.9 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.383 1.073 . . . . 0.0 112.166 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.75 -23.6 61.25 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.865 1.221 . . . . 0.0 115.327 -171.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 m -63.26 -32.68 74.15 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.908 1.354 . . . . 0.0 113.366 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.42 -33.55 32.1 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.418 0.687 . . . . 0.0 111.94 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.5 tp -65.94 -40.2 91.15 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.632 1.173 . . . . 0.0 111.929 169.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -60.94 -32.39 71.9 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.269 -0.894 . . . . 0.0 112.123 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -68.34 -41.88 80.11 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.189 0.995 . . . . 0.0 112.556 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -64.09 -34.87 79.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.745 0.818 . . . . 0.0 112.032 174.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.1 mt -72.62 -48.66 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 121.221 -0.924 . . . . 0.0 111.638 175.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -53.75 -28.41 34.36 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 112.852 173.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.46 -37.84 74.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.484 0.714 . . . . 0.0 112.681 175.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -69.8 -34.05 73.19 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.438 0.695 . . . . 0.0 112.267 171.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -72.5 -4.77 32.47 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.09 23.68 73.67 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.595 1.093 . . . . 0.0 115.063 175.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.6 t -67.02 141.55 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.749 1.219 . . . . 0.0 111.124 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.7 mttt . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.193 1.797 . . . . 0.0 111.787 -179.76 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 m -74.75 -17.58 60.62 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 t -150.81 156.5 41.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 111.706 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.84 68.08 2.84 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.406 1.479 . . . . 0.0 112.996 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.4 p -72.47 168.87 17.61 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.905 1.282 . . . . 0.0 113.652 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 m -75.83 2.39 12.45 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.97 176.17 33.78 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 125.165 1.364 . . . . 0.0 114.535 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.29 146.54 50.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.003 1.321 . . . . 0.0 111.628 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.02 175.39 9.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.876 1.271 . . . . 0.0 113.831 -174.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.26 170.99 14.73 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.691 1.996 . . . . 0.0 111.19 178.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -113.37 135.24 54.08 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.793 1.637 . . . . 0.0 111.416 176.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.7 t -56.68 141.1 74.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.571 1.548 . . . . 0.0 113.032 -169.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -73.04 -3.32 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.517 2.145 . . . . 0.0 113.94 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -126.28 -25.71 3.46 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.2 p -138.5 -177.01 4.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.458 1.103 . . . . 0.0 113.519 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -81.27 -6.14 58.55 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -81.7 151.53 27.48 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -105.31 147.9 27.63 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.299 1.44 . . . . 0.0 113.788 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -136.26 149.35 48.45 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.649 1.18 . . . . 0.0 111.202 169.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.7 ptm -74.75 171.36 14.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.061 0.944 . . . . 0.0 112.884 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -63.34 16.65 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -75.61 -17.67 59.94 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.46 -60.75 2.39 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.507 1.527 . . . . 0.0 114.432 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 m -64.27 -37.93 89.22 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -75.3 -31.93 60.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.518 -0.739 . . . . 0.0 111.923 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 50.7 tp -69.81 -42.44 73.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.093 0.957 . . . . 0.0 111.701 169.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -58.4 -45.55 88.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.845 0.858 . . . . 0.0 111.469 -178.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -68.64 -31.65 70.94 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -68.66 -37.18 79.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.595 0.758 . . . . 0.0 112.555 173.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -72.36 -47.09 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 O-C-N 121.021 -1.049 . . . . 0.0 111.221 175.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -52.7 -30.31 31.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.377 0.671 . . . . 0.0 112.655 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.99 68.17 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 176.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -65.76 -34.08 77.35 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.873 0.76 . . . . 0.0 112.079 170.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -73.73 -0.39 15.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.929 1.292 . . . . 0.0 113.895 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.77 14.81 82.17 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.083 1.325 . . . . 0.0 115.368 174.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.0 t -77.56 134.5 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.926 1.291 . . . . 0.0 110.671 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.615 1.966 . . . . 0.0 111.413 178.751 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.537 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 t -148.41 156.16 42.14 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.259 1.423 . . . . 0.0 111.649 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.4 p -150.1 161.4 42.44 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.449 1.5 . . . . 0.0 112.65 -178.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.61 179.88 48.8 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.841 1.21 . . . . 0.0 113.215 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.5 t -148.83 149.36 31.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.963 1.305 . . . . 0.0 111.799 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.3 m 55.7 22.35 5.32 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.376 1.87 . . . . 0.0 115.975 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 141.0 30.01 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.297 0.951 . . . . 0.0 113.017 177.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 45.6 ttp85 -133.95 13.29 3.97 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.168 1.387 . . . . 0.0 113.927 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.88 160.64 31.12 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.417 1.087 . . . . 0.0 112.812 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -82.88 128.82 34.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.066 1.346 . . . . 0.0 109.814 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -96.07 129.07 43.45 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.39 0.995 . . . . 0.0 111.473 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.7 t -52.8 137.33 44.7 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.947 0.899 . . . . 0.0 111.744 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -70.56 -2.91 11.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.915 2.41 . . . . 0.0 114.226 -178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -126.62 -25.17 3.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.9 p -140.14 -179.3 5.9 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.83 1.37 50.05 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -173.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -76.83 139.85 40.46 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.248 -0.908 . . . . 0.0 113.149 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -95.97 149.1 21.95 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -141.03 169.01 18.42 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.849 2.06 . . . . 0.0 112.336 -175.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -118.89 167.25 11.89 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.548 1.939 . . . . 0.0 109.156 169.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -71.39 40.19 0.06 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.884 2.074 . . . . 0.0 113.859 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.1 55.13 2.71 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.543 1.937 . . . . 0.0 111.951 -173.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.04 -124.2 33.48 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 124.703 1.144 . . . . 0.0 113.624 175.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -72.82 -8.39 55.27 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.75 -29.44 68.66 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.685 1.13 . . . . 0.0 113.421 -176.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp -81.28 -40.21 24.06 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.74 0.816 . . . . 0.0 111.006 168.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -61.02 -43.87 98.25 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 111.537 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -62.01 -33.84 75.09 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.941 0.896 . . . . 0.0 113.357 176.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -73.2 -36.67 66.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.152 0.981 . . . . 0.0 111.962 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.64 -48.46 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 121.283 -0.885 . . . . 0.0 111.553 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -54.39 -27.78 38.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.924 0.889 . . . . 0.0 112.644 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.39 -39.5 67.94 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 174.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.63 -34.47 77.94 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.701 0.682 . . . . 0.0 112.092 171.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.11 -7.28 51.98 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.388 1.075 . . . . 0.0 113.748 172.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.42 25.55 74.03 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.536 1.065 . . . . 0.0 114.847 177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 76.2 t -62.53 139.13 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.273 1.429 . . . . 0.0 111.34 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.953 1.701 . . . . 0.0 112.33 -176.036 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.607 0 N-CA-C 111.303 -0.719 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 m 56.01 28.27 12.53 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 175.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 t -151.23 152.77 33.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.411 1.484 . . . . 0.0 111.64 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 170.4 179.23 41.72 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 125.189 1.376 . . . . 0.0 113.146 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.4 m 51.99 38.94 25.15 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.518 1.527 . . . . 0.0 114.733 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.3 t -140.34 165.59 27.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.46 1.504 . . . . 0.0 112.321 -176.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.83 179.72 40.82 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.239 1.4 . . . . 0.0 114.956 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -77.24 45.73 0.47 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.516 1.926 . . . . 0.0 114.459 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 155.72 29.98 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.745 1.218 . . . . 0.0 113.285 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -77.02 135.91 38.68 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 125.764 1.626 . . . . 0.0 109.717 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -108.93 131.72 54.77 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.509 1.124 . . . . 0.0 111.952 171.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.1 t -54.51 138.38 60.27 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.519 1.127 . . . . 0.0 112.011 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.33 -2.77 12.21 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.913 2.409 . . . . 0.0 114.151 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -124.86 -28.0 3.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.1 -179.47 5.8 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -87.95 7.92 28.77 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -78.24 141.62 38.45 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.127 -0.983 . . . . 0.0 112.829 175.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.04 153.77 21.57 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.468 1.507 . . . . 0.0 114.068 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -130.0 140.09 50.94 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.714 1.606 . . . . 0.0 110.494 173.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -99.56 0.08 41.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.025 1.33 . . . . 0.0 113.824 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -146.08 142.72 28.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.883 1.673 . . . . 0.0 111.497 -172.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -92.5 147.98 22.46 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.479 1.111 . . . . 0.0 111.444 169.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.68 -158.38 30.56 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.439 1.019 . . . . 0.0 112.457 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.0 p -75.59 -25.54 57.11 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -64.34 -41.0 96.99 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.322 -0.861 . . . . 0.0 112.881 -173.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 59.0 tp -66.87 -38.1 85.67 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.095 0.558 . . . . 0.0 111.627 172.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -65.31 -43.63 90.45 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.64 -0.663 . . . . 0.0 111.279 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.4 mtm-85 -61.16 -43.51 98.77 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 118.807 0.73 . . . . 0.0 112.158 171.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -60.31 -37.6 81.09 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.343 0.657 . . . . 0.0 112.372 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.1 mt -74.4 -49.3 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.033 0.933 . . . . 0.0 111.786 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -54.01 -30.14 46.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 112.388 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.8 78.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.314 1.045 . . . . 0.0 113.134 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -67.88 -32.0 72.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.943 0.792 . . . . 0.0 112.075 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.5 0.76 13.71 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.327 1.051 . . . . 0.0 113.705 169.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.23 11.58 84.16 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.119 1.342 . . . . 0.0 115.467 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.0 t -79.62 136.65 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.798 1.239 . . . . 0.0 110.474 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 126.489 1.916 . . . . 0.0 111.581 179.97 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.504 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.7 p -63.7 -14.68 54.42 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.761 1.225 . . . . 0.0 114.189 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.2 p -67.25 -16.17 64.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.977 2.111 . . . . 0.0 114.514 169.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.4 154.24 53.14 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.554 1.074 . . . . 0.0 113.958 178.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.0 t -150.56 151.1 32.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.979 1.312 . . . . 0.0 112.088 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.2 p -78.33 -12.12 59.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.278 1.431 . . . . 0.0 113.488 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.54 -124.86 35.75 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.277 0.941 . . . . 0.0 112.634 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 93.5 mtm-85 -84.73 -6.67 59.36 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.836 1.254 . . . . 0.0 114.267 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -103.26 173.05 6.48 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.214 1.406 . . . . 0.0 113.17 -174.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -116.71 132.87 56.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.438 1.895 . . . . 0.0 109.302 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -98.51 128.55 44.9 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.513 1.051 . . . . 0.0 111.917 175.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.4 t -53.84 139.51 51.95 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 124.483 1.113 . . . . 0.0 112.24 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -72.67 -2.42 11.83 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 122.732 2.288 . . . . 0.0 114.214 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -125.37 -26.48 3.6 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.8 p -138.77 177.36 7.94 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -83.6 0.88 44.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -174.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -80.47 145.28 31.98 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.255 -0.903 . . . . 0.0 113.285 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -101.23 151.86 21.35 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.149 1.38 . . . . 0.0 114.6 -178.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -128.53 160.65 31.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.996 2.118 . . . . 0.0 111.274 174.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.94 159.68 43.26 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.417 1.487 . . . . 0.0 110.97 -176.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 52.54 -114.23 0.82 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.451 1.9 . . . . 0.0 113.301 176.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -73.87 128.01 34.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.336 1.054 . . . . 0.0 112.348 -171.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.91 1.39 59.1 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.067 1.318 . . . . 0.0 115.543 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.3 p -60.1 -37.45 80.02 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.377 1.588 . . . . 0.0 113.365 178.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -81.81 -34.11 30.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.108 0.963 . . . . 0.0 112.495 176.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.7 tp -62.35 -41.98 99.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.77 0.828 . . . . 0.0 111.786 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -59.33 -46.1 89.54 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.908 -0.495 . . . . 0.0 111.784 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.0 mtm-85 -64.31 -41.08 97.0 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.234 0.614 . . . . 0.0 112.237 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -62.24 -37.75 86.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.716 0.806 . . . . 0.0 112.61 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.4 mt -73.39 -48.46 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 O-C-N 121.098 -1.001 . . . . 0.0 111.596 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 30.2 m0 -54.25 -28.89 44.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.531 0.732 . . . . 0.0 112.374 174.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.22 -39.3 71.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.813 0.845 . . . . 0.0 113.03 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -66.1 -34.41 77.99 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.444 -0.785 . . . . 0.0 112.085 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.67 -4.42 34.24 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 171.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.54 21.56 78.57 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.648 1.118 . . . . 0.0 115.057 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.64 136.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.874 1.269 . . . . 0.0 110.785 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.323 1.449 . . . . 0.0 112.723 -179.245 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.7 p -80.18 167.83 19.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.895 1.278 . . . . 0.0 113.133 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 71.2 m -78.08 -10.19 59.5 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 177.6 156.1 15.47 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.663 1.602 . . . . 0.0 112.194 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 61.1 p -65.77 -22.84 66.61 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -174.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 86.4 p -83.8 -13.62 53.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.542 1.537 . . . . 0.0 113.959 172.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 70.14 10.81 66.2 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 124.503 1.049 . . . . 0.0 114.51 -169.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.3 mtm-85 -132.91 162.74 30.8 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.965 1.706 . . . . 0.0 112.544 -173.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -148.01 161.43 41.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.7 1.6 . . . . 0.0 111.546 173.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -83.55 130.08 34.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.707 1.603 . . . . 0.0 109.887 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -95.99 127.83 42.35 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.363 0.983 . . . . 0.0 111.752 174.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.3 t -51.96 138.19 35.03 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.37 1.068 . . . . 0.0 111.912 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -73.03 -1.35 10.39 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.405 2.07 . . . . 0.0 114.065 -178.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -125.77 -23.96 3.91 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.887 1.275 . . . . 0.0 114.342 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -142.17 -177.27 5.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -85.51 3.92 38.19 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -177.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -79.66 141.68 36.24 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.176 -0.952 . . . . 0.0 113.002 -178.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -101.87 148.97 24.68 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -134.18 156.01 49.11 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.797 2.039 . . . . 0.0 111.422 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.0 tpt -151.34 135.67 16.85 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.081 0.953 . . . . 0.0 110.88 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 57.73 -40.37 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 129.401 3.08 . . . . 0.0 117.968 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -82.27 80.27 8.52 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.854 1.206 . . . . 0.0 112.305 -174.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.89 70.24 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.19 0.9 . . . . 0.0 114.152 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -70.85 -44.08 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.661 1.231 . . . . 0.0 112.307 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -71.92 -32.97 67.89 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.663 -0.648 . . . . 0.0 111.888 176.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.04 -46.61 88.41 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.219 0.608 . . . . 0.0 111.24 169.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -61.0 -41.54 96.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.525 0.73 . . . . 0.0 111.376 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -62.27 -42.89 99.73 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.085 0.954 . . . . 0.0 112.328 172.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -65.13 -36.02 82.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.281 1.032 . . . . 0.0 112.713 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.1 mt -71.8 -47.07 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 O-C-N 120.814 -1.179 . . . . 0.0 111.625 175.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.4 m0 -54.56 -27.8 41.35 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.555 0.742 . . . . 0.0 112.689 171.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.91 -38.82 64.21 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.487 -0.758 . . . . 0.0 112.813 175.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -64.88 -37.17 86.74 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 118.822 0.737 . . . . 0.0 112.008 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -74.5 -4.25 35.67 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 114.278 173.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.99 27.08 74.24 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.37 0.985 . . . . 0.0 114.725 175.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.62 137.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.035 1.334 . . . . 0.0 111.229 -176.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.2 pttp . . . . . 0 C--O 1.254 1.338 0 C-N-CA 126.385 1.874 . . . . 0.0 112.724 -178.652 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.26 -0.336 . . . . 0.0 112.26 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.2 m -89.31 7.96 32.97 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.187 1.395 . . . . 0.0 114.761 -174.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.4 p -71.77 158.27 36.42 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.35 1.46 . . . . 0.0 113.588 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.94 -172.03 51.72 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.466 1.032 . . . . 0.0 114.038 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 98.2 p -150.1 161.06 43.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.953 1.301 . . . . 0.0 112.623 179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.7 m -96.39 0.24 50.28 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.018 1.327 . . . . 0.0 114.314 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.96 164.12 54.32 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.527 1.06 . . . . 0.0 114.307 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.6 ptt85 -83.46 0.74 44.96 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -177.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.48 174.74 7.0 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.643 1.177 . . . . 0.0 113.871 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 157.59 30.65 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.955 1.702 . . . . 0.0 110.978 174.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -114.28 137.3 51.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.547 1.539 . . . . 0.0 111.29 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -57.13 138.73 79.88 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 125.765 1.626 . . . . 0.0 112.383 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.37 -2.89 12.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 122.493 2.128 . . . . 0.0 113.83 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -126.43 -26.52 3.29 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.4 p -138.57 -171.69 3.12 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -79.04 -14.91 58.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.111 1.364 . . . . 0.0 113.87 -176.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -73.88 155.84 38.31 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -118.16 152.71 35.12 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.681 1.592 . . . . 0.0 113.916 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -132.53 149.14 52.37 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.679 1.191 . . . . 0.0 111.728 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -138.88 -1.07 1.83 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.467 1.507 . . . . 0.0 114.564 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -142.64 149.23 38.64 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.41 1.884 . . . . 0.0 111.193 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 55.0 t30 51.18 117.97 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 129.305 3.042 . . . . 0.0 116.996 178.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.44 82.63 Favored Glycine 0 CA--C 1.536 1.378 0 O-C-N 121.178 -0.952 . . . . 0.0 114.682 175.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.9 p -78.58 -20.97 49.33 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.801 1.8 . . . . 0.0 114.025 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -72.38 -35.47 68.47 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.364 -0.835 . . . . 0.0 111.333 169.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.79 -43.85 71.3 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.708 -0.62 . . . . 0.0 111.198 169.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -60.79 -43.44 98.1 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.611 -0.681 . . . . 0.0 111.804 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -69.97 -32.21 70.31 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -66.37 -37.37 85.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.767 0.827 . . . . 0.0 111.992 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.25 -47.31 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 O-C-N 121.1 -1.0 . . . . 0.0 111.552 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -54.21 -27.78 36.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.609 0.764 . . . . 0.0 112.902 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.29 -38.03 68.85 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.556 -0.715 . . . . 0.0 112.795 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -67.47 -35.22 78.75 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.591 -0.693 . . . . 0.0 112.075 171.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -73.84 -3.35 28.17 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.82 1.248 . . . . 0.0 114.131 171.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.37 25.16 75.96 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.487 1.042 . . . . 0.0 114.915 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.78 138.12 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.877 1.271 . . . . 0.0 111.09 -178.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.555 1.942 . . . . 0.0 111.555 178.773 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 m -66.42 152.44 45.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.428 1.091 . . . . 0.0 113.059 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.9 p -73.69 150.83 40.98 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.548 1.139 . . . . 0.0 113.267 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.75 177.39 52.36 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.747 1.165 . . . . 0.0 114.317 177.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.6 t -71.18 152.38 43.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.342 1.057 . . . . 0.0 112.426 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.6 p -73.6 -16.18 61.25 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.704 1.201 . . . . 0.0 113.398 170.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 59.95 -116.77 9.53 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 124.324 0.964 . . . . 0.0 112.977 174.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 58.6 ttm-85 -82.1 -9.58 59.48 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.203 1.401 . . . . 0.0 114.573 -178.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.14 172.67 12.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 169.5 17.37 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.73 1.612 . . . . 0.0 110.236 169.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.0 tttt -112.91 140.22 47.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.364 1.066 . . . . 0.0 111.341 170.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 37.4 t -58.31 137.69 84.98 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.735 1.214 . . . . 0.0 111.578 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -72.28 -3.37 13.21 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 122.999 2.466 . . . . 0.0 114.199 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -126.42 -27.33 3.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.2 p -135.57 -179.3 5.56 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -78.25 -2.41 37.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.866 1.267 . . . . 0.0 114.025 -175.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -83.77 154.11 23.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -170.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -118.6 148.01 43.13 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.026 1.73 . . . . 0.0 113.113 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -135.47 164.46 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.361 1.464 . . . . 0.0 110.382 168.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -144.69 136.22 25.51 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.287 1.435 . . . . 0.0 109.816 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . 0.265 63.5 pttt 51.96 -29.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 131.016 3.727 . . . . 0.0 119.422 -176.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -81.73 60.36 4.62 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.692 1.597 . . . . 0.0 112.595 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.02 -34.41 65.88 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.283 -0.885 . . . . 0.0 113.795 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.0 m -65.3 -20.47 66.42 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.602 1.161 . . . . 0.0 113.92 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.47 -34.39 12.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.198 1.399 . . . . 0.0 112.266 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -58.55 -39.76 81.11 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.013 0.925 . . . . 0.0 111.963 173.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -56.21 -40.78 74.58 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.865 -0.522 . . . . 0.0 111.98 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -66.19 -43.68 86.15 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.108 0.963 . . . . 0.0 111.411 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.77 -36.98 82.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.032 0.933 . . . . 0.0 112.32 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.7 mt -75.18 -49.39 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 O-C-N 121.313 -0.867 . . . . 0.0 111.783 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -55.5 -27.65 49.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.325 0.65 . . . . 0.0 112.478 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.17 73.16 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.717 0.807 . . . . 0.0 112.923 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.77 -33.69 76.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.943 0.792 . . . . 0.0 112.173 171.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.18 -3.28 28.82 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.8 21.29 78.79 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.694 1.14 . . . . 0.0 115.104 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.12 137.79 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.747 1.219 . . . . 0.0 110.899 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.091 0 C-N-CA 126.075 1.75 . . . . 0.0 112.997 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.63 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -76.56 160.71 29.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.753 1.221 . . . . 0.0 113.284 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.4 t -148.87 165.76 30.56 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.325 1.45 . . . . 0.0 111.601 178.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.5 154.57 52.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.597 1.094 . . . . 0.0 114.214 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.9 p -87.78 -5.27 58.72 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 -177.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -63.03 145.97 54.26 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.159 1.384 . . . . 0.0 113.432 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 179.84 174.96 46.2 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.727 1.156 . . . . 0.0 113.376 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -109.5 5.42 23.24 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.477 1.511 . . . . 0.0 114.467 -176.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.22 161.72 27.94 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -172.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -115.24 139.58 49.83 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.49 2.716 . . . . 0.0 108.681 177.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -109.91 130.56 55.51 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.938 1.295 . . . . 0.0 112.717 174.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -54.97 140.06 62.07 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.336 1.455 . . . . 0.0 112.599 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -75.34 -3.53 14.02 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.865 2.377 . . . . 0.0 114.135 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -123.84 -29.37 3.69 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.3 p -134.13 -178.47 5.05 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.47 -16.77 59.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.497 1.119 . . . . 0.0 113.915 -175.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.55 150.79 45.73 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -168.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.01 153.25 23.36 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.609 1.564 . . . . 0.0 115.189 -176.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -133.8 151.77 51.67 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.726 1.61 . . . . 0.0 111.518 170.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.2 ttp -81.96 -31.32 31.28 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.428 0.691 . . . . 0.0 110.819 167.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -88.29 164.56 15.52 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.528 1.931 . . . . 0.0 113.236 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -135.62 168.72 18.74 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 108.932 169.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.31 -139.75 23.64 Favored Glycine 0 CA--C 1.533 1.171 0 O-C-N 121.09 -1.006 . . . . 0.0 113.419 -179.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m -50.89 -42.22 59.01 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.026 1.862 . . . . 0.0 116.026 -168.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -75.44 -30.26 59.96 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.619 1.099 . . . . 0.0 113.325 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.0 tp -72.52 -35.4 68.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.811 0.844 . . . . 0.0 110.88 169.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.32 -29.28 68.76 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.403 -0.81 . . . . 0.0 112.379 -178.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -56.36 -45.63 80.39 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.172 1.389 . . . . 0.0 112.446 171.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -74.73 -32.47 62.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.066 1.347 . . . . 0.0 112.343 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.6 mt -72.13 -47.76 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.253 -0.905 . . . . 0.0 111.42 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -52.66 -29.08 24.39 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 112.94 172.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.41 73.03 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.52 0.728 . . . . 0.0 112.556 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -70.69 -32.91 70.32 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.582 0.753 . . . . 0.0 112.401 171.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.3 -3.44 23.79 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.41 18.56 75.77 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 124.759 1.171 . . . . 0.0 115.317 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.47 135.83 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 118.589 1.195 . . . . 0.0 110.413 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.458 1.903 . . . . 0.0 111.296 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.4 m -67.42 149.91 49.62 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.542 1.137 . . . . 0.0 113.108 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.3 m -67.34 143.07 56.56 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.397 1.079 . . . . 0.0 112.761 -179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.88 -2.11 90.64 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.623 1.106 . . . . 0.0 115.588 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.5 m -67.62 148.0 51.97 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.195 1.398 . . . . 0.0 113.659 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.6 m -137.29 151.73 48.99 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.699 1.6 . . . . 0.0 111.835 178.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.83 -174.42 47.03 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.768 1.175 . . . . 0.0 113.09 179.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -141.02 145.79 36.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.711 1.604 . . . . 0.0 111.406 175.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -152.85 176.79 11.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.758 1.623 . . . . 0.0 111.641 175.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.4 156.73 27.42 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.881 1.672 . . . . 0.0 110.739 173.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -116.98 139.69 50.36 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.82 1.248 . . . . 0.0 111.504 172.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 41.9 t -56.96 137.35 79.67 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.874 1.27 . . . . 0.0 111.993 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -69.83 -3.68 12.54 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.086 2.524 . . . . 0.0 114.045 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.48 -28.9 2.73 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.7 p -136.75 -173.72 3.51 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -82.79 -5.07 58.76 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.807 1.243 . . . . 0.0 114.272 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -78.96 150.87 31.92 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -174.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -115.45 151.55 34.55 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.96 1.704 . . . . 0.0 113.157 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -135.19 148.33 49.65 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.475 1.51 . . . . 0.0 109.382 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 27.8 ttt -83.45 125.83 32.12 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.39 -0.819 . . . . 0.0 109.835 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt 55.33 -179.46 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.179 1.791 . . . . 0.0 113.621 -172.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -83.73 156.19 22.7 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.039 0.935 . . . . 0.0 110.392 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -178.2 172.02 44.47 Favored Glycine 0 CA--C 1.532 1.108 0 O-C-N 121.379 -0.826 . . . . 0.0 114.318 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.0 p -63.22 -36.78 84.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.942 0.897 . . . . 0.0 113.187 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -72.52 -28.4 62.83 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.086 -1.009 . . . . 0.0 112.716 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.7 tp -69.54 -39.75 77.28 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.824 -0.548 . . . . 0.0 110.445 168.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -60.94 -41.01 95.45 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.8 . . . . 0.0 111.532 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -58.99 -50.8 72.7 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.126 0.97 . . . . 0.0 112.011 169.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -58.12 -37.51 74.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.389 1.076 . . . . 0.0 112.584 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.8 mt -74.4 -50.0 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 124.083 0.953 . . . . 0.0 111.796 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.7 m0 -51.55 -32.75 29.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.231 0.612 . . . . 0.0 112.598 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.17 84.83 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.241 1.017 . . . . 0.0 112.918 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -71.74 -29.54 64.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.503 0.721 . . . . 0.0 112.631 171.147 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.04 -4.03 39.09 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 173.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.11 36.78 56.25 Favored Glycine 0 CA--C 1.535 1.316 0 O-C-N 121.241 -0.912 . . . . 0.0 113.74 178.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.7 p -52.87 146.43 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 125.574 1.55 . . . . 0.0 113.385 178.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt . . . . . 0 C--O 1.254 1.328 0 C-N-CA 126.322 1.849 . . . . 0.0 111.909 -177.636 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 119.041 -0.504 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -116.37 138.16 51.56 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.479 1.111 . . . . 0.0 112.567 176.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -57.07 139.53 78.9 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 126.006 1.722 . . . . 0.0 112.611 -173.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -72.3 -2.72 12.11 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.565 2.177 . . . . 0.0 114.01 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -126.38 -28.24 3.09 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.8 p -139.6 -171.39 3.13 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -175.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -82.27 -3.45 55.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.432 1.493 . . . . 0.0 114.038 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -82.66 154.97 24.63 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -171.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.475 0.804 0 C-N-CA 125.602 1.561 . . . . 0.0 114.253 -176.645 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.0 tp . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.3 mm100 -64.28 -43.85 93.51 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.676 -0.64 . . . . 0.0 110.602 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -64.45 -41.7 96.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.917 0.887 . . . . 0.0 112.255 173.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -61.82 -37.47 84.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.638 0.775 . . . . 0.0 112.549 176.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.5 mt -73.68 -47.98 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.148 -0.97 . . . . 0.0 111.548 175.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.4 m0 -55.63 -27.44 49.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -39.09 73.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.08 0.952 . . . . 0.0 112.862 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -67.35 -33.91 76.21 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.168 171.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -73.14 -0.98 15.71 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.941 1.297 . . . . 0.0 113.938 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.391 0 C-N-CA 124.777 1.179 . . . . 0.0 115.477 173.378 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.186 -0.435 . . . . 0.0 110.365 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -115.02 137.5 51.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.816 1.246 . . . . 0.0 111.741 174.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.03 138.15 83.76 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.801 1.24 . . . . 0.0 112.324 -176.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -71.35 -3.92 13.93 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.016 2.477 . . . . 0.0 114.113 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -126.61 -28.74 2.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.5 p -133.81 179.63 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -177.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.25 -4.2 54.81 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -83.86 158.56 21.6 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 . . . . . 0 N--CA 1.468 0.46 0 C-N-CA 125.917 1.687 . . . . 0.0 113.166 -174.928 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp . . . . . 0 CA--C 1.534 0.356 0 N-CA-C 111.1 0.037 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -61.26 -41.21 96.52 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.596 -0.69 . . . . 0.0 111.224 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.28 -41.41 85.49 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.515 0.726 . . . . 0.0 112.213 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -59.66 -37.36 78.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.693 0.797 . . . . 0.0 112.429 174.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -73.52 -49.46 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 O-C-N 121.327 -0.858 . . . . 0.0 111.59 176.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -50.88 -32.69 21.29 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.743 0.817 . . . . 0.0 112.531 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.47 -34.34 74.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.018 0.927 . . . . 0.0 113.274 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.3 -29.8 67.73 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.452 -0.78 . . . . 0.0 112.113 171.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.67 1.43 17.05 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.607 1.163 . . . . 0.0 113.304 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.448 0 C-N-CA 125.644 1.593 . . . . 0.0 115.382 177.855 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 119.014 -0.517 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -117.5 136.3 53.33 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.844 1.258 . . . . 0.0 112.032 176.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.26 140.83 78.35 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.046 1.738 . . . . 0.0 113.224 -170.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.6 -3.52 13.63 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.687 2.258 . . . . 0.0 114.203 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -125.55 -28.06 3.35 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.9 p -138.06 -172.94 3.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.06 -2.29 56.42 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -78.96 153.97 29.95 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -173.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 125.431 1.492 . . . . 0.0 114.191 -176.512 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.8 tp . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -57.82 -46.6 84.46 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.177 0.591 . . . . 0.0 111.109 176.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -62.73 -42.36 99.62 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.436 0.694 . . . . 0.0 112.614 174.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -62.42 -36.98 84.06 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 112.697 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.4 mt -73.8 -48.71 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 O-C-N 121.053 -1.029 . . . . 0.0 111.401 176.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -54.08 -30.29 47.68 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.397 0.679 . . . . 0.0 112.217 174.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -37.96 76.24 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.18 0.992 . . . . 0.0 113.109 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -67.01 -32.96 74.54 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.942 0.792 . . . . 0.0 112.141 170.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -73.96 0.47 13.41 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.428 1.091 . . . . 0.0 113.821 169.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.409 0 C-N-CA 124.978 1.275 . . . . 0.0 115.482 175.013 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.588 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -105.66 137.17 43.96 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.28 1.432 . . . . 0.0 112.484 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -55.63 134.69 71.53 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.234 1.414 . . . . 0.0 112.422 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.44 -4.08 14.6 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.1 2.533 . . . . 0.0 114.108 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -120.91 -30.2 4.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . 0.25 16.1 p -125.69 -132.34 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.274 1.03 . . . . 0.0 112.651 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -139.14 11.23 2.59 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.328 1.851 . . . . 0.0 112.98 -175.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -81.99 149.5 28.11 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.139 -0.976 . . . . 0.0 112.301 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.47 0.563 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -176.871 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 tp . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.74 -0.171 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -57.03 -43.81 82.28 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.653 -0.654 . . . . 0.0 111.243 172.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -63.15 -43.78 97.33 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.032 0.833 . . . . 0.0 112.322 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -61.08 -38.57 86.74 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.606 0.763 . . . . 0.0 112.589 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.8 mt -74.39 -48.91 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.207 -0.933 . . . . 0.0 111.782 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.9 m0 -52.9 -30.94 37.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.599 0.759 . . . . 0.0 112.555 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.57 -37.28 76.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.113 0.965 . . . . 0.0 113.064 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -68.15 -31.6 71.28 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.502 -0.749 . . . . 0.0 112.13 171.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -74.72 0.36 15.52 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.317 1.047 . . . . 0.0 113.672 169.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 C-N-CA 125.217 1.389 . . . . 0.0 115.375 175.572 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.537 0 CA-C-O 119.107 -0.473 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -116.59 138.26 51.56 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.592 1.157 . . . . 0.0 112.623 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.97 139.05 78.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.787 1.635 . . . . 0.0 112.556 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -71.66 -3.49 13.2 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.811 2.34 . . . . 0.0 113.702 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -126.83 -28.16 2.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.25 -172.68 3.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -176.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.29 -3.72 55.81 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.229 1.412 . . . . 0.0 114.054 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -82.99 155.4 23.98 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -171.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 . . . . . 0 N--CA 1.472 0.649 0 C-N-CA 125.619 1.568 . . . . 0.0 113.905 -176.577 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 tp . . . . . 0 N--CA 1.468 0.474 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -55.61 -45.09 77.56 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 118.324 0.511 . . . . 0.0 111.266 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -66.77 -43.21 84.63 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.718 1.207 . . . . 0.0 112.053 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -60.34 -38.46 83.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.681 1.192 . . . . 0.0 112.66 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.4 mt -74.68 -48.52 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 121.075 -1.015 . . . . 0.0 111.576 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -53.49 -29.48 36.35 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.155 0.582 . . . . 0.0 112.433 173.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -39.95 70.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.906 0.882 . . . . 0.0 112.945 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -65.48 -34.09 77.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.909 0.777 . . . . 0.0 112.177 170.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.26 -5.34 41.5 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.438 1.095 . . . . 0.0 113.882 172.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.393 0 C-N-CA 124.486 1.041 . . . . 0.0 114.933 176.759 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.464 0 CA-C-O 119.361 -0.352 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -114.97 139.12 50.09 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.583 1.153 . . . . 0.0 111.775 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.02 137.29 80.09 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.96 1.304 . . . . 0.0 112.204 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.06 -4.06 13.47 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 122.958 2.439 . . . . 0.0 114.138 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -127.54 -27.55 2.86 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.6 p -137.7 -171.08 2.91 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -85.02 -5.87 59.34 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.846 1.258 . . . . 0.0 114.308 -173.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -75.04 152.64 38.66 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 . . . . . 0 N--CA 1.469 0.482 0 C-N-CA 125.743 1.617 . . . . 0.0 113.154 179.767 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 110.548 -0.167 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -60.33 -43.65 96.22 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.79 -0.569 . . . . 0.0 110.779 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.5 ttp85 -58.9 -46.36 88.06 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.084 1.354 . . . . 0.0 112.845 171.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -60.49 -36.94 79.51 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.943 0.897 . . . . 0.0 112.451 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.2 mt -75.08 -49.06 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.089 0.956 . . . . 0.0 111.831 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -54.58 -28.48 46.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.862 0.865 . . . . 0.0 112.55 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.17 -37.55 75.22 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.821 0.848 . . . . 0.0 112.964 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -68.68 -33.83 74.63 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.452 -0.78 . . . . 0.0 112.138 171.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.0 -3.58 27.0 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.321 0 C-N-CA 124.766 1.175 . . . . 0.0 115.361 175.155 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.0 tmm? . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -111.98 131.1 55.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.892 1.277 . . . . 0.0 112.154 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.0 t -53.95 139.53 53.0 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.335 1.454 . . . . 0.0 112.87 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -73.32 -2.68 12.45 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.689 2.259 . . . . 0.0 114.036 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -124.86 -27.85 3.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.4 p -138.79 -174.9 3.96 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -83.09 -1.45 52.83 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.081 1.352 . . . . 0.0 114.545 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.26 146.36 43.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.396 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.1 tp . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -61.75 -42.71 99.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.134 0.573 . . . . 0.0 110.906 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.4 mtm180 -66.92 -41.56 86.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.909 0.884 . . . . 0.0 112.204 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -63.97 -38.04 89.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 112.678 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.1 mt -73.28 -48.09 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.004 -1.06 . . . . 0.0 111.309 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 15.4 m0 -51.5 -31.43 23.8 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.277 0.631 . . . . 0.0 112.608 172.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.31 -38.92 71.7 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.502 0.721 . . . . 0.0 112.86 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.7 -33.34 75.41 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.57 -0.706 . . . . 0.0 112.279 170.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -73.89 -2.58 24.44 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.546 1.138 . . . . 0.0 113.781 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.51 0 C-N-CA 124.916 1.246 . . . . 0.0 115.149 176.209 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.521 0 CA-C-O 119.447 -0.311 . . . . 0.0 110.755 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -115.32 138.13 51.3 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.714 1.205 . . . . 0.0 112.288 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 40.7 t -57.33 137.5 81.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.237 1.415 . . . . 0.0 112.522 -173.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.85 -4.46 14.12 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 122.987 2.458 . . . . 0.0 114.061 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -128.56 -26.84 2.69 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -135.45 -174.44 3.63 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.26 -4.46 57.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.884 1.273 . . . . 0.0 113.961 -174.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -81.98 153.56 26.17 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 N--CA 1.473 0.683 0 C-N-CA 125.591 1.557 . . . . 0.0 114.022 -177.37 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 49.3 tp . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.62 -44.69 93.35 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.556 -0.715 . . . . 0.0 111.462 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -69.13 -32.54 71.99 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.29 -37.54 87.65 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.974 0.806 . . . . 0.0 111.79 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.91 -49.43 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.353 -0.842 . . . . 0.0 111.811 176.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.5 m0 -54.31 -29.4 47.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.328 0.651 . . . . 0.0 112.644 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.39 -37.98 77.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.033 0.933 . . . . 0.0 113.047 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -67.88 -32.55 73.11 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.414 -0.804 . . . . 0.0 112.165 171.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.93 -0.52 16.38 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.361 1.064 . . . . 0.0 113.712 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.464 0 C-N-CA 125.0 1.286 . . . . 0.0 115.377 175.205 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.509 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -113.19 141.03 47.43 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.229 1.012 . . . . 0.0 111.355 171.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 44.4 t -55.05 139.57 63.72 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.552 1.541 . . . . 0.0 112.573 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -71.21 -4.88 15.81 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.046 2.497 . . . . 0.0 114.03 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -126.4 -25.84 3.41 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.0 p -135.48 -166.97 1.93 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.241 1.016 . . . . 0.0 113.302 177.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -104.91 16.25 26.29 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.209 1.403 . . . . 0.0 113.461 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -78.55 146.35 34.31 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.851 0.861 . . . . 0.0 111.973 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 . . . . . 0 N--CA 1.471 0.617 0 C-N-CA 124.794 1.238 . . . . 0.0 113.955 -176.163 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 47.0 tp . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 110.8 -0.074 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.92 -34.51 77.61 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.174 -0.954 . . . . 0.0 112.125 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -64.65 -47.21 79.33 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.916 1.287 . . . . 0.0 112.098 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -57.84 -37.16 73.37 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.414 0.686 . . . . 0.0 112.21 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 80.0 mt -73.76 -48.82 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.012 0.925 . . . . 0.0 112.061 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.3 m0 -53.83 -28.16 33.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.608 0.763 . . . . 0.0 112.846 174.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.87 74.71 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.505 0.722 . . . . 0.0 112.841 175.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -71.32 -34.02 70.2 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.454 0.702 . . . . 0.0 112.216 171.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.73 -5.74 36.16 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 170.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.223 0 C-N-CA 124.618 1.104 . . . . 0.0 114.935 175.214 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.69 132.7 54.43 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.302 1.041 . . . . 0.0 112.169 172.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -55.8 137.27 71.81 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.385 1.074 . . . . 0.0 111.729 -178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -72.16 -2.84 12.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.792 2.328 . . . . 0.0 114.217 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -127.22 -25.83 3.18 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.3 p -136.06 179.65 6.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.38 -3.28 49.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -173.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -80.15 151.23 29.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -171.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.585 1.554 . . . . 0.0 115.01 -175.023 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 119.778 -0.154 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -58.23 -43.77 87.94 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.857 -0.527 . . . . 0.0 111.092 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -66.4 -39.57 89.11 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.142 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -61.93 -37.13 83.54 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.315 1.046 . . . . 0.0 112.317 173.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.9 mt -72.1 -47.6 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 O-C-N 121.04 -1.037 . . . . 0.0 111.36 174.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -56.45 -25.81 51.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.533 0.733 . . . . 0.0 112.67 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.27 -37.88 66.12 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.122 -0.986 . . . . 0.0 112.775 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -67.96 -33.89 75.52 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.548 -0.72 . . . . 0.0 112.037 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -72.52 -4.72 32.28 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.98 1.312 . . . . 0.0 114.037 170.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.386 0 C-N-CA 124.413 1.006 . . . . 0.0 114.936 175.599 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.8 tmm? . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 118.605 -0.712 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -113.97 131.56 56.29 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.024 1.33 . . . . 0.0 112.583 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -55.79 140.29 68.19 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.351 1.46 . . . . 0.0 112.861 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -74.36 -3.65 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.828 2.352 . . . . 0.0 114.098 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -124.99 -28.69 3.43 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -135.89 -177.22 4.59 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.242 1.017 . . . . 0.0 113.693 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -81.74 -0.67 44.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.997 1.319 . . . . 0.0 114.446 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -75.08 149.92 39.0 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 . . . . . 0 N--CA 1.472 0.653 0 C-N-CA 125.361 1.464 . . . . 0.0 114.595 -176.306 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.5 tp . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -60.94 -32.39 71.9 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.269 -0.894 . . . . 0.0 112.123 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -68.34 -41.88 80.11 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.189 0.995 . . . . 0.0 112.556 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -64.09 -34.87 79.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.745 0.818 . . . . 0.0 112.032 174.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.1 mt -72.62 -48.66 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 121.221 -0.924 . . . . 0.0 111.638 175.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -53.75 -28.41 34.36 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 112.852 173.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.46 -37.84 74.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.484 0.714 . . . . 0.0 112.681 175.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -69.8 -34.05 73.19 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.438 0.695 . . . . 0.0 112.267 171.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -72.5 -4.77 32.47 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.407 0 C-N-CA 124.595 1.093 . . . . 0.0 115.063 175.065 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 119.529 -0.272 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -113.37 135.24 54.08 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.793 1.637 . . . . 0.0 111.416 176.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.7 t -56.68 141.1 74.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.571 1.548 . . . . 0.0 113.032 -169.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -73.04 -3.32 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.517 2.145 . . . . 0.0 113.94 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -126.28 -25.71 3.46 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.2 p -138.5 -177.01 4.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.458 1.103 . . . . 0.0 113.519 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -81.27 -6.14 58.55 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -81.7 151.53 27.48 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 . . . . . 0 N--CA 1.471 0.599 0 C-N-CA 125.299 1.44 . . . . 0.0 113.788 -179.129 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 50.7 tp . . . . . 0 CA--C 1.538 0.489 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -58.4 -45.55 88.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.845 0.858 . . . . 0.0 111.469 -178.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -68.64 -31.65 70.94 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -68.66 -37.18 79.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.595 0.758 . . . . 0.0 112.555 173.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -72.36 -47.09 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 O-C-N 121.021 -1.049 . . . . 0.0 111.221 175.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -52.7 -30.31 31.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.377 0.671 . . . . 0.0 112.655 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.99 68.17 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 176.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -65.76 -34.08 77.35 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.873 0.76 . . . . 0.0 112.079 170.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -73.73 -0.39 15.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.929 1.292 . . . . 0.0 113.895 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.384 0 C-N-CA 125.083 1.325 . . . . 0.0 115.368 174.991 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.814 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -96.07 129.07 43.45 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.39 0.995 . . . . 0.0 111.473 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.7 t -52.8 137.33 44.7 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.947 0.899 . . . . 0.0 111.744 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -70.56 -2.91 11.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.915 2.41 . . . . 0.0 114.226 -178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -126.62 -25.17 3.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.9 p -140.14 -179.3 5.9 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.83 1.37 50.05 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -173.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -76.83 139.85 40.46 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.248 -0.908 . . . . 0.0 113.149 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 . . . . . 0 N--CA 1.468 0.451 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.426 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp . . . . . 0 CA--C 1.539 0.554 0 CA-C-O 120.589 0.233 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -61.02 -43.87 98.25 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 111.537 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -62.01 -33.84 75.09 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.941 0.896 . . . . 0.0 113.357 176.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -73.2 -36.67 66.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.152 0.981 . . . . 0.0 111.962 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.64 -48.46 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 121.283 -0.885 . . . . 0.0 111.553 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -54.39 -27.78 38.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.924 0.889 . . . . 0.0 112.644 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.39 -39.5 67.94 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 174.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.63 -34.47 77.94 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.701 0.682 . . . . 0.0 112.092 171.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.11 -7.28 51.98 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.388 1.075 . . . . 0.0 113.748 172.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.369 0 C-N-CA 124.536 1.065 . . . . 0.0 114.847 177.261 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? . . . . . 0 CA--C 1.537 0.481 0 CA-C-O 118.63 -0.7 . . . . 0.0 109.717 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -108.93 131.72 54.77 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.509 1.124 . . . . 0.0 111.952 171.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.1 t -54.51 138.38 60.27 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.519 1.127 . . . . 0.0 112.011 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.33 -2.77 12.21 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.913 2.409 . . . . 0.0 114.151 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -124.86 -28.0 3.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.1 -179.47 5.8 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -87.95 7.92 28.77 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -78.24 141.62 38.45 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.127 -0.983 . . . . 0.0 112.829 175.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 . . . . . 0 CA--C 1.536 0.412 0 C-N-CA 125.468 1.507 . . . . 0.0 114.068 179.38 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -65.31 -43.63 90.45 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.64 -0.663 . . . . 0.0 111.279 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.4 mtm-85 -61.16 -43.51 98.77 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 118.807 0.73 . . . . 0.0 112.158 171.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -60.31 -37.6 81.09 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.343 0.657 . . . . 0.0 112.372 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.1 mt -74.4 -49.3 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.033 0.933 . . . . 0.0 111.786 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -54.01 -30.14 46.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 112.388 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.8 78.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.314 1.045 . . . . 0.0 113.134 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -67.88 -32.0 72.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.943 0.792 . . . . 0.0 112.075 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.5 0.76 13.71 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.327 1.051 . . . . 0.0 113.705 169.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.348 0 C-N-CA 125.119 1.342 . . . . 0.0 115.467 175.282 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? . . . . . 0 CA--C 1.54 0.587 0 CA-C-O 118.597 -0.715 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -98.51 128.55 44.9 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.513 1.051 . . . . 0.0 111.917 175.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.4 t -53.84 139.51 51.95 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 124.483 1.113 . . . . 0.0 112.24 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -72.67 -2.42 11.83 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 122.732 2.288 . . . . 0.0 114.214 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -125.37 -26.48 3.6 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.8 p -138.77 177.36 7.94 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -83.6 0.88 44.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -174.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -80.47 145.28 31.98 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.255 -0.903 . . . . 0.0 113.285 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 125.149 1.38 . . . . 0.0 114.6 -178.478 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.7 tp . . . . . 0 CA--C 1.537 0.444 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -59.33 -46.1 89.54 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.908 -0.495 . . . . 0.0 111.784 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.0 mtm-85 -64.31 -41.08 97.0 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.234 0.614 . . . . 0.0 112.237 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -62.24 -37.75 86.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.716 0.806 . . . . 0.0 112.61 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.4 mt -73.39 -48.46 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 O-C-N 121.098 -1.001 . . . . 0.0 111.596 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 30.2 m0 -54.25 -28.89 44.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.531 0.732 . . . . 0.0 112.374 174.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.22 -39.3 71.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.813 0.845 . . . . 0.0 113.03 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -66.1 -34.41 77.99 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.444 -0.785 . . . . 0.0 112.085 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.67 -4.42 34.24 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 171.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.482 0 C-N-CA 124.648 1.118 . . . . 0.0 115.057 176.383 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? . . . . . 0 CA--C 1.539 0.524 0 CA-C-O 118.92 -0.562 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -95.99 127.83 42.35 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.363 0.983 . . . . 0.0 111.752 174.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.3 t -51.96 138.19 35.03 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.37 1.068 . . . . 0.0 111.912 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -73.03 -1.35 10.39 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.405 2.07 . . . . 0.0 114.065 -178.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -125.77 -23.96 3.91 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.887 1.275 . . . . 0.0 114.342 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -142.17 -177.27 5.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -85.51 3.92 38.19 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -177.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -79.66 141.68 36.24 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.176 -0.952 . . . . 0.0 113.002 -178.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.472 0.648 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -178.263 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.9 tp . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 119.907 -0.092 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -61.0 -41.54 96.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.525 0.73 . . . . 0.0 111.376 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -62.27 -42.89 99.73 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.085 0.954 . . . . 0.0 112.328 172.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -65.13 -36.02 82.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.281 1.032 . . . . 0.0 112.713 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.1 mt -71.8 -47.07 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 O-C-N 120.814 -1.179 . . . . 0.0 111.625 175.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.4 m0 -54.56 -27.8 41.35 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.555 0.742 . . . . 0.0 112.689 171.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.91 -38.82 64.21 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.487 -0.758 . . . . 0.0 112.813 175.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -64.88 -37.17 86.74 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 118.822 0.737 . . . . 0.0 112.008 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -74.5 -4.25 35.67 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 114.278 173.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.479 0 C-N-CA 124.37 0.985 . . . . 0.0 114.725 175.981 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 119.384 -0.341 . . . . 0.0 110.978 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -114.28 137.3 51.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.547 1.539 . . . . 0.0 111.29 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -57.13 138.73 79.88 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 125.765 1.626 . . . . 0.0 112.383 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.37 -2.89 12.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 122.493 2.128 . . . . 0.0 113.83 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -126.43 -26.52 3.29 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.4 p -138.57 -171.69 3.12 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -79.04 -14.91 58.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.111 1.364 . . . . 0.0 113.87 -176.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -73.88 155.84 38.31 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 125.681 1.592 . . . . 0.0 113.916 -178.099 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.4 tp . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -60.79 -43.44 98.1 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.611 -0.681 . . . . 0.0 111.804 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -69.97 -32.21 70.31 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -66.37 -37.37 85.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.767 0.827 . . . . 0.0 111.992 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.25 -47.31 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 O-C-N 121.1 -1.0 . . . . 0.0 111.552 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -54.21 -27.78 36.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.609 0.764 . . . . 0.0 112.902 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.29 -38.03 68.85 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.556 -0.715 . . . . 0.0 112.795 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -67.47 -35.22 78.75 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.591 -0.693 . . . . 0.0 112.075 171.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -73.84 -3.35 28.17 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.82 1.248 . . . . 0.0 114.131 171.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.378 0 C-N-CA 124.487 1.042 . . . . 0.0 114.915 174.735 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.0 tttt -112.91 140.22 47.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.364 1.066 . . . . 0.0 111.341 170.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 37.4 t -58.31 137.69 84.98 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.735 1.214 . . . . 0.0 111.578 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -72.28 -3.37 13.21 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 122.999 2.466 . . . . 0.0 114.199 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -126.42 -27.33 3.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.2 p -135.57 -179.3 5.56 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -78.25 -2.41 37.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.866 1.267 . . . . 0.0 114.025 -175.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -83.77 154.11 23.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -170.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 . . . . . 0 N--CA 1.472 0.648 0 C-N-CA 126.026 1.73 . . . . 0.0 113.113 -178.735 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -56.21 -40.78 74.58 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.865 -0.522 . . . . 0.0 111.98 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -66.19 -43.68 86.15 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.108 0.963 . . . . 0.0 111.411 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.77 -36.98 82.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.032 0.933 . . . . 0.0 112.32 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.7 mt -75.18 -49.39 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 O-C-N 121.313 -0.867 . . . . 0.0 111.783 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -55.5 -27.65 49.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.325 0.65 . . . . 0.0 112.478 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.17 73.16 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.717 0.807 . . . . 0.0 112.923 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.77 -33.69 76.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.943 0.792 . . . . 0.0 112.173 171.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.18 -3.28 28.82 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.518 0 C-N-CA 124.694 1.14 . . . . 0.0 115.104 175.482 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -109.91 130.56 55.51 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.938 1.295 . . . . 0.0 112.717 174.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -54.97 140.06 62.07 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.336 1.455 . . . . 0.0 112.599 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -75.34 -3.53 14.02 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.865 2.377 . . . . 0.0 114.135 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -123.84 -29.37 3.69 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.3 p -134.13 -178.47 5.05 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.47 -16.77 59.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.497 1.119 . . . . 0.0 113.915 -175.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.55 150.79 45.73 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -168.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 . . . . . 0 N--CA 1.47 0.536 0 C-N-CA 125.609 1.564 . . . . 0.0 115.189 -176.741 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.0 tp . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 120.69 0.281 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.32 -29.28 68.76 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.403 -0.81 . . . . 0.0 112.379 -178.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -56.36 -45.63 80.39 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.172 1.389 . . . . 0.0 112.446 171.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -74.73 -32.47 62.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.066 1.347 . . . . 0.0 112.343 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.6 mt -72.13 -47.76 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.253 -0.905 . . . . 0.0 111.42 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -52.66 -29.08 24.39 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 112.94 172.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.41 73.03 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.52 0.728 . . . . 0.0 112.556 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -70.69 -32.91 70.32 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.582 0.753 . . . . 0.0 112.401 171.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.3 -3.44 23.79 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.32 0 C-N-CA 124.759 1.171 . . . . 0.0 115.317 174.207 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 119.754 -0.165 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -116.98 139.69 50.36 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.82 1.248 . . . . 0.0 111.504 172.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 41.9 t -56.96 137.35 79.67 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.874 1.27 . . . . 0.0 111.993 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -69.83 -3.68 12.54 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.086 2.524 . . . . 0.0 114.045 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.48 -28.9 2.73 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.7 p -136.75 -173.72 3.51 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -82.79 -5.07 58.76 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.807 1.243 . . . . 0.0 114.272 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -78.96 150.87 31.92 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -174.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 . . . . . 0 N--CA 1.469 0.522 0 C-N-CA 125.96 1.704 . . . . 0.0 113.157 179.796 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.7 tp . . . . . 0 N--CA 1.468 0.458 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -60.94 -41.01 95.45 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.8 . . . . 0.0 111.532 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -58.99 -50.8 72.7 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.126 0.97 . . . . 0.0 112.011 169.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -58.12 -37.51 74.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.389 1.076 . . . . 0.0 112.584 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.8 mt -74.4 -50.0 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 124.083 0.953 . . . . 0.0 111.796 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.7 m0 -51.55 -32.75 29.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.231 0.612 . . . . 0.0 112.598 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.17 84.83 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.241 1.017 . . . . 0.0 112.918 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -71.74 -29.54 64.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.503 0.721 . . . . 0.0 112.631 171.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.04 -4.03 39.09 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 173.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.316 0 O-C-N 121.241 -0.912 . . . . 0.0 113.74 178.053 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.5 m -64.81 -22.21 66.94 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.9 p -81.52 -14.83 56.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.642 1.577 . . . . 0.0 114.235 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.89 146.33 4.58 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 125.41 1.481 . . . . 0.0 112.691 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.0 69.92 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -171.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 66.1 p -107.87 -0.83 21.27 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.033 1.733 . . . . 0.0 114.209 178.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.02 -136.14 48.64 Favored Glycine 0 CA--C 1.539 1.554 0 C-N-CA 124.206 0.908 . . . . 0.0 113.064 -175.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 52.35 43.55 30.72 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.469 1.908 . . . . 0.0 114.346 172.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.14 165.62 19.98 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.085 0.954 . . . . 0.0 112.558 172.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.46 152.55 36.11 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.537 0.735 . . . . 0.0 110.276 171.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -116.37 138.16 51.56 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.479 1.111 . . . . 0.0 112.567 176.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -57.07 139.53 78.9 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 126.006 1.722 . . . . 0.0 112.611 -173.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -72.3 -2.72 12.11 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.565 2.177 . . . . 0.0 114.01 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -126.38 -28.24 3.09 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.765 1.395 . . . . 0.0 114.765 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.8 p -139.6 -171.39 3.13 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 -175.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -82.27 -3.45 55.26 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.432 1.493 . . . . 0.0 114.038 -175.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -82.66 154.97 24.63 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -171.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -119.76 150.11 40.93 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.602 1.561 . . . . 0.0 114.253 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -141.45 167.73 21.47 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.251 1.42 . . . . 0.0 112.239 170.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.45 140.92 58.65 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.548 -0.72 . . . . 0.0 109.664 168.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -56.96 -20.15 22.11 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -169.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -124.89 16.77 8.61 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.996 1.718 . . . . 0.0 113.016 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -70.9 134.56 23.7 Favored Glycine 0 CA--C 1.535 1.306 0 O-C-N 120.94 -1.1 . . . . 0.0 113.102 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 t -71.47 -31.11 66.76 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 121.847 -0.796 . . . . 0.0 112.864 -179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -62.48 -24.64 67.57 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.308 1.043 . . . . 0.0 113.241 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.0 tp -60.2 -38.12 82.32 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.863 0.865 . . . . 0.0 112.032 172.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.3 mm100 -64.28 -43.85 93.51 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.676 -0.64 . . . . 0.0 110.602 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.5 tpt180 -64.45 -41.7 96.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.917 0.887 . . . . 0.0 112.255 173.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -61.82 -37.47 84.54 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.638 0.775 . . . . 0.0 112.549 176.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.5 mt -73.68 -47.98 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.148 -0.97 . . . . 0.0 111.548 175.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.4 m0 -55.63 -27.44 49.67 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.64 -39.09 73.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.08 0.952 . . . . 0.0 112.862 173.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -67.35 -33.91 76.21 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.168 171.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -73.14 -0.98 15.71 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.941 1.297 . . . . 0.0 113.938 170.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.03 15.56 80.36 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.777 1.179 . . . . 0.0 115.477 173.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.9 t -71.08 135.24 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-N 118.761 1.28 . . . . 0.0 110.139 176.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.019 1.328 . . . . 0.0 113.065 -177.94 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.8 m -136.02 151.26 49.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.274 1.43 . . . . 0.0 111.992 -176.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 38.5 m -70.01 144.88 52.13 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.383 1.073 . . . . 0.0 112.855 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 161.81 -169.43 37.24 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.624 1.107 . . . . 0.0 113.742 178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 m -69.92 -3.16 14.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.138 1.375 . . . . 0.0 114.491 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.8 p -74.93 -5.97 46.69 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.532 1.933 . . . . 0.0 114.62 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -54.95 124.51 32.7 Favored Glycine 0 CA--C 1.537 1.439 0 C-N-CA 124.336 0.97 . . . . 0.0 113.085 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 55.88 18.2 2.89 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.944 2.097 . . . . 0.0 115.901 -174.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.41 176.94 5.01 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.043 1.337 . . . . 0.0 111.837 169.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.67 152.36 26.61 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.162 1.385 . . . . 0.0 110.365 169.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -115.02 137.5 51.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.816 1.246 . . . . 0.0 111.741 174.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.3 t -58.03 138.15 83.76 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 124.801 1.24 . . . . 0.0 112.324 -176.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -71.35 -3.92 13.93 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.016 2.477 . . . . 0.0 114.113 177.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -126.61 -28.74 2.97 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.828 1.418 . . . . 0.0 114.828 -178.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.5 p -133.81 179.63 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -177.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -81.25 -4.2 54.81 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -172.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -83.86 158.56 21.6 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.38 1.252 . . . . 0.0 114.38 -173.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -119.21 153.35 35.1 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.917 1.687 . . . . 0.0 113.166 -174.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -128.91 144.55 51.21 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.937 1.295 . . . . 0.0 109.776 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.0 ptm -84.48 -10.47 57.45 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 176.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -135.77 162.13 33.63 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 127.061 2.144 . . . . 0.0 110.82 178.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.9 p-10 -105.27 20.14 19.38 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 125.912 1.685 . . . . 0.0 113.894 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -71.95 -177.09 28.13 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.957 1.265 . . . . 0.0 114.988 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 m -59.25 -25.45 64.07 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -172.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -62.12 -36.57 82.17 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.288 -0.883 . . . . 0.0 112.441 175.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -69.17 -40.12 78.34 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.301 0.64 . . . . 0.0 111.1 172.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -61.26 -41.21 96.52 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.596 -0.69 . . . . 0.0 111.224 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.28 -41.41 85.49 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.515 0.726 . . . . 0.0 112.213 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -59.66 -37.36 78.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.693 0.797 . . . . 0.0 112.429 174.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.3 mt -73.52 -49.46 36.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 O-C-N 121.327 -0.858 . . . . 0.0 111.59 176.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -50.88 -32.69 21.29 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.743 0.817 . . . . 0.0 112.531 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.47 -34.34 74.22 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.018 0.927 . . . . 0.0 113.274 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.3 -29.8 67.73 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.452 -0.78 . . . . 0.0 112.113 171.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.67 1.43 17.05 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.607 1.163 . . . . 0.0 113.304 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.11 4.16 90.33 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.644 1.593 . . . . 0.0 115.382 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 40.6 t -80.64 140.39 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.282 1.433 . . . . 0.0 110.262 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? . . . . . 0 C--O 1.25 1.123 0 C-N-CA 125.093 1.357 . . . . 0.0 112.262 -172.88 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 110.854 -0.898 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 p -79.8 143.9 34.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.505 1.122 . . . . 0.0 113.609 -177.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -66.25 168.43 8.68 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.532 1.933 . . . . 0.0 114.034 -173.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.15 26.63 73.37 Favored Glycine 0 CA--C 1.535 1.34 0 O-C-N 121.587 -0.696 . . . . 0.0 114.195 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.4 m 58.59 26.66 14.7 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.718 1.607 . . . . 0.0 114.622 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.8 m -71.52 -35.62 70.78 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.28 -0.887 . . . . 0.0 111.375 169.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.63 125.31 6.9 Favored Glycine 0 CA--C 1.534 1.233 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 168.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -128.24 19.66 6.37 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.79 1.236 . . . . 0.0 114.272 -171.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.07 166.61 17.75 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.454 1.102 . . . . 0.0 112.274 169.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.86 154.55 39.42 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.101 0.56 . . . . 0.0 110.587 172.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -117.5 136.3 53.33 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.844 1.258 . . . . 0.0 112.032 176.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.7 t -57.26 140.83 78.35 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.046 1.738 . . . . 0.0 113.224 -170.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.6 -3.52 13.63 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.687 2.258 . . . . 0.0 114.203 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -125.55 -28.06 3.35 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.9 p -138.06 -172.94 3.38 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -84.06 -2.29 56.42 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -78.96 153.97 29.95 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -173.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -116.12 149.28 39.25 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.431 1.492 . . . . 0.0 114.191 -176.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -138.49 157.73 45.62 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.768 1.227 . . . . 0.0 113.091 170.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 3.2 ppp? -99.82 -178.47 3.87 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.655 1.582 . . . . 0.0 112.119 171.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -65.81 9.5 0.13 Allowed 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 118.384 2.735 . . . . 0.0 118.384 -168.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -64.66 -37.61 88.17 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 119.97 1.259 . . . . 0.0 112.072 172.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.79 -41.86 1.26 Allowed Glycine 0 CA--C 1.535 1.336 0 C-N-CA 125.921 1.724 . . . . 0.0 117.063 169.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 62.9 p -67.57 -32.48 73.26 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.853 1.826 . . . . 0.0 113.214 -177.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -70.17 -41.87 73.2 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.488 1.515 . . . . 0.0 112.648 171.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.08 -43.91 97.82 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.003 0.921 . . . . 0.0 111.771 171.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -57.82 -46.6 84.46 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 123.177 0.591 . . . . 0.0 111.109 176.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -62.73 -42.36 99.62 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.436 0.694 . . . . 0.0 112.614 174.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 60.2 t60 -62.42 -36.98 84.06 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.91 0.884 . . . . 0.0 112.697 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.4 mt -73.8 -48.71 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 O-C-N 121.053 -1.029 . . . . 0.0 111.401 176.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m0 -54.08 -30.29 47.68 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.397 0.679 . . . . 0.0 112.217 174.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.87 -37.96 76.24 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.18 0.992 . . . . 0.0 113.109 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -67.01 -32.96 74.54 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.942 0.792 . . . . 0.0 112.141 170.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -73.96 0.47 13.41 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.428 1.091 . . . . 0.0 113.821 169.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.62 11.46 84.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.978 1.275 . . . . 0.0 115.482 175.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.9 t -78.56 137.12 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 124.721 1.208 . . . . 0.0 110.277 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt . . . . . 0 C--O 1.253 1.251 0 C-N-CA 125.811 1.645 . . . . 0.0 111.421 -178.738 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 111.592 -0.603 . . . . 0.0 111.592 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 60.4 p -74.08 157.62 35.73 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.574 1.149 . . . . 0.0 113.039 176.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.2 t -152.57 162.61 40.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.958 1.303 . . . . 0.0 111.905 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.86 176.79 46.36 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.216 1.389 . . . . 0.0 115.128 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.2 m -68.49 152.14 45.81 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.841 1.256 . . . . 0.0 113.101 -178.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 20.8 m 54.69 33.91 20.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.53 1.532 . . . . 0.0 114.576 176.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.15 12.24 5.62 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 125.664 1.602 . . . . 0.0 116.591 -174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -66.33 148.49 51.78 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 118.973 1.387 . . . . 0.0 112.672 178.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -149.31 174.06 12.83 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.548 1.539 . . . . 0.0 112.223 -168.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.43 148.48 41.08 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.512 -0.742 . . . . 0.0 110.588 173.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -105.66 137.17 43.96 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.28 1.432 . . . . 0.0 112.484 178.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 48.8 t -55.63 134.69 71.53 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 125.234 1.414 . . . . 0.0 112.422 176.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -76.44 -4.08 14.6 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.1 2.533 . . . . 0.0 114.108 178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -120.91 -30.2 4.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . 0.25 16.1 p -125.69 -132.34 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.274 1.03 . . . . 0.0 112.651 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -139.14 11.23 2.59 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.328 1.851 . . . . 0.0 112.98 -175.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -81.99 149.5 28.11 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.139 -0.976 . . . . 0.0 112.301 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -112.26 146.52 38.04 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -176.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -138.38 152.02 48.03 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.953 1.301 . . . . 0.0 112.901 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 96.6 mmm -84.18 -172.56 4.23 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.963 1.305 . . . . 0.0 111.576 170.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -65.91 -2.84 4.26 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -76.2 65.52 2.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.529 1.532 . . . . 0.0 111.201 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.58 -18.64 59.22 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.12 1.343 . . . . 0.0 115.681 -170.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -58.79 -32.92 69.76 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 118.82 1.31 . . . . 0.0 113.338 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -88.56 -27.92 21.08 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 176.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.87 -37.86 88.57 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.537 -0.727 . . . . 0.0 111.375 170.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -57.03 -43.81 82.28 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.653 -0.654 . . . . 0.0 111.243 172.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -63.15 -43.78 97.33 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.032 0.833 . . . . 0.0 112.322 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -61.08 -38.57 86.74 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.606 0.763 . . . . 0.0 112.589 176.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.8 mt -74.39 -48.91 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 O-C-N 121.207 -0.933 . . . . 0.0 111.782 177.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 32.9 m0 -52.9 -30.94 37.16 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.599 0.759 . . . . 0.0 112.555 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.57 -37.28 76.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.113 0.965 . . . . 0.0 113.064 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -68.15 -31.6 71.28 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.502 -0.749 . . . . 0.0 112.13 171.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -74.72 0.36 15.52 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.317 1.047 . . . . 0.0 113.672 169.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.37 12.78 83.48 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.217 1.389 . . . . 0.0 115.375 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.2 t -79.19 136.79 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 110.634 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 C-N-CA 126.078 1.751 . . . . 0.0 111.741 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 60.9 m -90.11 -9.51 48.08 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -177.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.3 m -67.52 150.27 49.07 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.918 1.287 . . . . 0.0 113.02 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.99 144.76 43.76 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 123.758 0.694 . . . . 0.0 113.379 176.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.2 m -111.61 12.44 21.23 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.12 1.368 . . . . 0.0 113.861 -176.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 57.7 p -147.06 168.96 20.25 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.673 1.589 . . . . 0.0 112.507 -177.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.79 69.38 1.52 Allowed Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.609 1.576 . . . . 0.0 113.973 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -81.88 -9.75 59.5 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.874 1.67 . . . . 0.0 114.209 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -139.34 166.29 24.95 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.491 1.916 . . . . 0.0 111.5 174.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.22 156.36 24.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.175 0.99 . . . . 0.0 110.69 172.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -116.59 138.26 51.56 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.592 1.157 . . . . 0.0 112.623 175.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.97 139.05 78.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.787 1.635 . . . . 0.0 112.556 -173.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -71.66 -3.49 13.2 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.811 2.34 . . . . 0.0 113.702 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -126.83 -28.16 2.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -137.25 -172.68 3.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -176.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.29 -3.72 55.81 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.229 1.412 . . . . 0.0 114.054 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -82.99 155.4 23.98 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -171.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -118.88 149.21 41.95 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.619 1.568 . . . . 0.0 113.905 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -139.38 159.39 42.26 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.758 1.223 . . . . 0.0 112.431 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 92.3 mmm -78.56 160.96 27.34 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.999 0.92 . . . . 0.0 112.199 173.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -61.52 -13.2 19.28 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.365 1.987 . . . . 0.0 116.365 -170.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -64.28 -34.56 78.4 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.416 1.086 . . . . 0.0 112.506 176.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.36 -0.3 33.64 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 117.49 1.756 . . . . 0.0 117.49 169.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.8 m -60.3 -40.16 89.53 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.608 1.704 . . . . 0.0 114.14 -169.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -94.16 -19.7 20.54 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.817 0.847 . . . . 0.0 112.898 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.9 tp -61.91 -40.04 94.07 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.997 0.919 . . . . 0.0 111.597 172.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -55.61 -45.09 77.56 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 118.324 0.511 . . . . 0.0 111.266 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -66.77 -43.21 84.63 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.718 1.207 . . . . 0.0 112.053 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.5 t60 -60.34 -38.46 83.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.681 1.192 . . . . 0.0 112.66 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 71.4 mt -74.68 -48.52 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 121.075 -1.015 . . . . 0.0 111.576 176.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 28.9 m0 -53.49 -29.48 36.35 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.155 0.582 . . . . 0.0 112.433 173.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.39 -39.95 70.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.906 0.882 . . . . 0.0 112.945 174.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -65.48 -34.09 77.45 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.909 0.777 . . . . 0.0 112.177 170.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -74.26 -5.34 41.5 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.438 1.095 . . . . 0.0 113.882 172.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.45 23.38 75.63 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.486 1.041 . . . . 0.0 114.933 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.12 138.36 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.803 1.241 . . . . 0.0 110.866 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 99.5 mttt . . . . . 0 C--O 1.252 1.231 0 C-N-CA 126.34 1.856 . . . . 0.0 111.591 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.0 p -74.78 158.38 33.59 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.699 1.199 . . . . 0.0 113.158 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.7 t -149.29 152.0 35.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 111.492 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 75.02 -41.39 1.27 Allowed Glycine 0 CA--C 1.539 1.552 0 C-N-CA 125.974 1.75 . . . . 0.0 114.985 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.8 t -152.67 151.71 30.89 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.867 1.667 . . . . 0.0 111.691 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.8 p -86.14 -10.02 55.58 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.115 1.366 . . . . 0.0 113.387 169.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.93 178.61 48.51 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 125.093 1.33 . . . . 0.0 114.352 176.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 86.7 mtm180 -131.5 156.8 45.04 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.894 1.678 . . . . 0.0 112.0 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.07 168.63 20.47 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.135 1.774 . . . . 0.0 111.236 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.93 149.19 29.51 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.407 0.683 . . . . 0.0 110.082 169.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -114.97 139.12 50.09 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.583 1.153 . . . . 0.0 111.775 173.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.5 t -57.02 137.29 80.09 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.96 1.304 . . . . 0.0 112.204 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.06 -4.06 13.47 Favored 'Trans proline' 0 CA--C 1.544 0.98 0 C-N-CA 122.958 2.439 . . . . 0.0 114.138 178.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -127.54 -27.55 2.86 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.6 p -137.7 -171.08 2.91 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -85.02 -5.87 59.34 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.846 1.258 . . . . 0.0 114.308 -173.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -75.04 152.64 38.66 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -175.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -117.47 150.12 39.45 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.743 1.617 . . . . 0.0 113.154 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -133.34 144.79 49.86 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.985 1.314 . . . . 0.0 110.573 169.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.7 tpt -95.37 130.7 42.07 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.628 0.771 . . . . 0.0 110.17 169.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 57.24 171.27 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 126.64 1.976 . . . . 0.0 114.129 -169.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -80.03 155.0 27.8 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.422 1.089 . . . . 0.0 111.806 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.25 163.91 29.54 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 123.647 0.641 . . . . 0.0 114.025 176.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -63.94 -25.19 68.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -72.41 -28.68 63.13 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.353 -0.842 . . . . 0.0 112.63 177.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp -71.4 -40.6 70.4 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.634 -0.666 . . . . 0.0 110.548 168.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.8 mm-40 -60.33 -43.65 96.22 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.79 -0.569 . . . . 0.0 110.779 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.5 ttp85 -58.9 -46.36 88.06 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.084 1.354 . . . . 0.0 112.845 171.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -60.49 -36.94 79.51 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.943 0.897 . . . . 0.0 112.451 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 75.2 mt -75.08 -49.06 29.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.089 0.956 . . . . 0.0 111.831 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.2 m0 -54.58 -28.48 46.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.862 0.865 . . . . 0.0 112.55 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.17 -37.55 75.22 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.821 0.848 . . . . 0.0 112.964 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -68.68 -33.83 74.63 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.452 -0.78 . . . . 0.0 112.138 171.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -73.0 -3.58 27.0 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 170.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.57 19.28 79.36 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 124.766 1.175 . . . . 0.0 115.361 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.9 t -68.62 142.57 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.586 1.554 . . . . 0.0 111.051 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.2 mttp . . . . . 0 C--O 1.255 1.356 0 C-N-CA 125.968 1.707 . . . . 0.0 112.009 -173.312 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m -74.05 -20.33 60.33 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -173.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 52.8 m -137.23 144.14 42.64 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.616 1.567 . . . . 0.0 111.67 -178.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -80.35 164.6 47.68 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 124.334 0.968 . . . . 0.0 113.899 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.0 p -79.61 155.21 28.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.071 1.349 . . . . 0.0 112.485 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 44.5 m -76.23 140.74 41.77 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.072 0.949 . . . . 0.0 113.164 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 65.53 -162.3 41.32 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.57 1.081 . . . . 0.0 114.717 176.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mmm180 -83.83 58.32 4.59 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.215 1.406 . . . . 0.0 111.682 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.99 163.37 24.76 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.507 1.123 . . . . 0.0 113.512 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -113.88 137.62 51.42 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.446 2.298 . . . . 0.0 109.037 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -111.98 131.1 55.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.892 1.277 . . . . 0.0 112.154 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 29.0 t -53.95 139.53 53.0 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.335 1.454 . . . . 0.0 112.87 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -73.32 -2.68 12.45 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 122.689 2.259 . . . . 0.0 114.036 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -124.86 -27.85 3.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.4 p -138.79 -174.9 3.96 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -83.09 -1.45 52.83 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.081 1.352 . . . . 0.0 114.545 -177.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.26 146.36 43.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.93 148.64 30.38 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -134.25 173.37 11.68 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.49 1.916 . . . . 0.0 110.743 170.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.8 ttp -140.45 148.09 40.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.764 1.225 . . . . 0.0 111.265 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt 51.5 29.53 5.46 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 126.401 1.881 . . . . 0.0 115.102 177.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.8 t30 49.48 45.44 23.96 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.094 1.757 . . . . 0.0 113.792 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.09 149.25 45.25 Favored Glycine 0 CA--C 1.537 1.451 0 C-N-CA 123.921 0.772 . . . . 0.0 113.474 178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.8 p -64.05 -18.41 64.32 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -172.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -65.46 -23.51 66.94 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.084 -1.01 . . . . 0.0 113.129 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.1 tp -63.17 -40.67 98.23 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.324 0.966 . . . . 0.0 111.554 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -61.75 -42.71 99.33 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.134 0.573 . . . . 0.0 110.906 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.4 mtm180 -66.92 -41.56 86.85 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.909 0.884 . . . . 0.0 112.204 175.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -63.97 -38.04 89.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.433 1.093 . . . . 0.0 112.678 177.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.1 mt -73.28 -48.09 43.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.004 -1.06 . . . . 0.0 111.309 175.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 15.4 m0 -51.5 -31.43 23.8 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.277 0.631 . . . . 0.0 112.608 172.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.31 -38.92 71.7 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.502 0.721 . . . . 0.0 112.86 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -66.7 -33.34 75.41 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.57 -0.706 . . . . 0.0 112.279 170.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -73.89 -2.58 24.44 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.546 1.138 . . . . 0.0 113.781 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.94 16.95 80.33 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.916 1.246 . . . . 0.0 115.149 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 41.1 t -73.92 135.18 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.995 1.318 . . . . 0.0 110.607 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 C--O 1.253 1.252 0 C-N-CA 126.431 1.893 . . . . 0.0 111.517 179.028 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 m -66.74 146.81 54.05 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.357 1.063 . . . . 0.0 112.864 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.5 t -135.4 -57.31 0.8 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.155 0.982 . . . . 0.0 113.203 -171.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 55.74 -148.88 26.22 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 124.241 0.924 . . . . 0.0 114.743 176.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.0 p -78.16 -22.77 48.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.4 p -85.41 -12.01 53.06 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.292 1.437 . . . . 0.0 113.792 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.85 5.44 74.87 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 125.424 1.487 . . . . 0.0 115.124 -177.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ptt-85 -159.97 150.96 19.21 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 118.852 1.326 . . . . 0.0 114.105 -170.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.19 170.41 16.16 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.951 0.9 . . . . 0.0 111.827 168.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.73 153.35 20.34 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.681 1.192 . . . . 0.0 110.755 171.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -115.32 138.13 51.3 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.714 1.205 . . . . 0.0 112.288 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 40.7 t -57.33 137.5 81.18 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.237 1.415 . . . . 0.0 112.522 -173.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.85 -4.46 14.12 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 122.987 2.458 . . . . 0.0 114.061 178.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -128.56 -26.84 2.69 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.7 p -135.45 -174.44 3.63 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.26 -4.46 57.18 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.884 1.273 . . . . 0.0 113.961 -174.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -81.98 153.56 26.17 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -116.15 147.76 41.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.591 1.557 . . . . 0.0 114.022 -177.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -140.77 160.18 40.6 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.675 1.59 . . . . 0.0 110.426 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.5 ttt -150.92 128.64 11.57 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 121.047 -1.033 . . . . 0.0 111.215 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . 0.287 62.9 pttt 47.98 27.27 1.15 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.835 2.054 . . . . 0.0 115.577 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 36.0 m120 -86.47 -11.06 52.86 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.883 1.273 . . . . 0.0 113.993 -177.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.39 -121.98 28.21 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.502 1.049 . . . . 0.0 113.66 172.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m -55.89 -25.69 43.9 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.09 1.356 . . . . 0.0 114.334 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.99 -31.77 69.63 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 121.463 -0.773 . . . . 0.0 112.69 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 49.3 tp -74.82 -39.25 61.75 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.735 -0.603 . . . . 0.0 110.584 169.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.62 -44.69 93.35 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.556 -0.715 . . . . 0.0 111.462 179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.2 ptt180 -69.13 -32.54 71.99 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 175.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.29 -37.54 87.65 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.974 0.806 . . . . 0.0 111.79 171.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.91 -49.43 34.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.353 -0.842 . . . . 0.0 111.811 176.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 25.5 m0 -54.31 -29.4 47.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.328 0.651 . . . . 0.0 112.644 175.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.39 -37.98 77.76 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.033 0.933 . . . . 0.0 113.047 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -67.88 -32.55 73.11 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.414 -0.804 . . . . 0.0 112.165 171.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.93 -0.52 16.38 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.361 1.064 . . . . 0.0 113.712 169.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.66 13.81 82.76 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 125.0 1.286 . . . . 0.0 115.377 175.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.3 t -74.86 134.24 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 CA-C-N 118.457 1.129 . . . . 0.0 110.478 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 126.234 1.814 . . . . 0.0 112.896 179.866 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 112.144 -0.383 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 m -68.41 153.2 44.22 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.645 1.178 . . . . 0.0 113.226 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 87.9 p -144.73 166.29 25.62 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.63 1.572 . . . . 0.0 112.171 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.45 -149.04 39.75 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.015 0.817 . . . . 0.0 113.465 -176.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 m -62.63 146.58 51.71 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.722 1.209 . . . . 0.0 113.584 -176.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 t -78.6 168.69 19.4 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.474 1.11 . . . . 0.0 112.649 176.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.42 -160.87 51.24 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.909 1.242 . . . . 0.0 113.963 -177.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -131.81 161.57 32.61 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.994 1.718 . . . . 0.0 112.098 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.29 165.51 27.22 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.761 1.624 . . . . 0.0 112.366 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.4 150.99 28.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.354 1.062 . . . . 0.0 109.632 168.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -113.19 141.03 47.43 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.229 1.012 . . . . 0.0 111.355 171.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 44.4 t -55.05 139.57 63.72 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.552 1.541 . . . . 0.0 112.573 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -71.21 -4.88 15.81 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.046 2.497 . . . . 0.0 114.03 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -126.4 -25.84 3.41 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.0 p -135.48 -166.97 1.93 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.241 1.016 . . . . 0.0 113.302 177.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -104.91 16.25 26.29 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.209 1.403 . . . . 0.0 113.461 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -78.55 146.35 34.31 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.851 0.861 . . . . 0.0 111.973 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -114.35 147.56 38.95 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.794 1.238 . . . . 0.0 113.955 -176.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -131.48 135.75 47.36 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.898 1.279 . . . . 0.0 110.366 169.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -74.56 -33.36 62.69 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.439 -0.788 . . . . 0.0 112.091 176.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -108.95 156.93 19.14 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.17 1.788 . . . . 0.0 112.162 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -105.79 133.56 50.33 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.954 1.302 . . . . 0.0 109.367 169.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.36 -165.21 38.22 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.636 0.636 . . . . 0.0 114.148 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.6 p -60.9 -36.44 79.24 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -173.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -69.81 -31.47 69.39 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.089 -1.007 . . . . 0.0 112.439 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 47.0 tp -72.87 -40.28 65.78 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.551 0.74 . . . . 0.0 110.8 169.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -62.92 -34.51 77.61 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.174 -0.954 . . . . 0.0 112.125 177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.6 mmt180 -64.65 -47.21 79.33 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.916 1.287 . . . . 0.0 112.098 169.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -57.84 -37.16 73.37 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.414 0.686 . . . . 0.0 112.21 175.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 80.0 mt -73.76 -48.82 38.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 124.012 0.925 . . . . 0.0 112.061 175.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 17.3 m0 -53.83 -28.16 33.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.608 0.763 . . . . 0.0 112.846 174.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.87 74.71 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.505 0.722 . . . . 0.0 112.841 175.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -71.32 -34.02 70.2 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.454 0.702 . . . . 0.0 112.216 171.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -71.73 -5.74 36.16 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 170.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.64 23.76 74.32 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.618 1.104 . . . . 0.0 114.935 175.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -64.74 137.69 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.873 1.269 . . . . 0.0 110.955 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm . . . . . 0 C--O 1.254 1.299 0 C-N-CA 125.367 1.467 . . . . 0.0 112.692 -175.699 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.137 -0.385 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.7 p -147.51 162.02 39.92 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.387 1.475 . . . . 0.0 112.553 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m -68.04 150.41 48.48 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.61 1.164 . . . . 0.0 113.035 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.88 -166.59 35.68 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.354 0.978 . . . . 0.0 113.646 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.9 m -73.91 8.18 2.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.56 1.544 . . . . 0.0 115.163 -174.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.5 m -65.69 -20.98 66.5 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 126.221 1.808 . . . . 0.0 114.563 -176.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -60.13 119.65 19.36 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.226 0.917 . . . . 0.0 112.789 -177.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 55.53 17.29 2.19 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 126.685 1.994 . . . . 0.0 115.167 -174.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -88.34 162.29 16.65 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.865 1.266 . . . . 0.0 112.686 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -74.66 134.52 41.99 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.016 1.327 . . . . 0.0 109.128 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.69 132.7 54.43 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.302 1.041 . . . . 0.0 112.169 172.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.4 t -55.8 137.27 71.81 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 124.385 1.074 . . . . 0.0 111.729 -178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -72.16 -2.84 12.23 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.792 2.328 . . . . 0.0 114.217 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -127.22 -25.83 3.18 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 -178.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.3 p -136.06 179.65 6.22 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -80.38 -3.28 49.06 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -173.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -80.15 151.23 29.88 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -171.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -111.9 151.4 29.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.585 1.554 . . . . 0.0 115.01 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -133.74 148.36 51.41 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.997 1.719 . . . . 0.0 110.304 173.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 28.5 ptm -74.75 -32.21 62.02 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -148.91 161.51 41.72 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.069 2.148 . . . . 0.0 111.246 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -74.51 149.58 40.2 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.86 0.864 . . . . 0.0 110.493 168.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 172.33 179.52 43.24 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.577 1.084 . . . . 0.0 113.393 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.6 p -60.75 -29.52 69.44 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -71.15 -37.59 72.25 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.535 0.734 . . . . 0.0 112.394 176.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.1 tp -67.88 -42.92 80.49 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.264 0.625 . . . . 0.0 110.909 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -58.23 -43.77 87.94 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.857 -0.527 . . . . 0.0 111.092 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -66.4 -39.57 89.11 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.142 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -61.93 -37.13 83.54 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.315 1.046 . . . . 0.0 112.317 173.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.9 mt -72.1 -47.6 53.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 O-C-N 121.04 -1.037 . . . . 0.0 111.36 174.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 26.8 m0 -56.45 -25.81 51.84 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.533 0.733 . . . . 0.0 112.67 173.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.27 -37.88 66.12 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.122 -0.986 . . . . 0.0 112.775 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -67.96 -33.89 75.52 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 121.548 -0.72 . . . . 0.0 112.037 170.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -72.52 -4.72 32.28 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.98 1.312 . . . . 0.0 114.037 170.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.3 27.18 66.43 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.413 1.006 . . . . 0.0 114.936 175.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 44.6 t -79.39 134.19 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.14 1.376 . . . . 0.0 111.117 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.165 0 C-N-CA 127.464 2.306 . . . . 0.0 112.163 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.1 p -62.69 -25.22 68.05 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.7 p -58.47 -26.31 63.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.954 1.302 . . . . 0.0 113.451 171.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.62 -15.56 73.37 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.427 1.013 . . . . 0.0 114.488 172.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.5 m -108.18 -39.7 5.4 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.147 1.379 . . . . 0.0 112.577 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 63.7 m -77.86 -20.12 53.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 177.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -60.0 123.43 33.09 Favored Glycine 0 CA--C 1.534 1.279 0 O-C-N 121.303 -0.873 . . . . 0.0 112.71 -178.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 53.03 28.56 6.87 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 126.178 1.791 . . . . 0.0 114.312 -174.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -139.92 171.54 14.06 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.702 1.601 . . . . 0.0 112.467 -177.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -108.08 138.82 43.68 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.874 1.67 . . . . 0.0 109.468 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -113.97 131.56 56.29 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.024 1.33 . . . . 0.0 112.583 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.3 t -55.79 140.29 68.19 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.351 1.46 . . . . 0.0 112.861 -174.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -74.36 -3.65 14.16 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.828 2.352 . . . . 0.0 114.098 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -124.99 -28.69 3.43 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -135.89 -177.22 4.59 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.242 1.017 . . . . 0.0 113.693 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -81.74 -0.67 44.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.997 1.319 . . . . 0.0 114.446 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -75.08 149.92 39.0 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -174.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.04 151.16 29.66 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.361 1.464 . . . . 0.0 114.595 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -127.88 151.03 49.57 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.483 1.513 . . . . 0.0 112.557 173.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 ptm -140.11 26.67 2.21 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.21 2.204 . . . . 0.0 111.784 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -131.44 172.66 11.93 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 127.18 2.192 . . . . 0.0 111.927 -169.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -59.94 148.51 34.9 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.383 1.073 . . . . 0.0 112.166 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.75 -23.6 61.25 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.865 1.221 . . . . 0.0 115.327 -171.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 m -63.26 -32.68 74.15 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.908 1.354 . . . . 0.0 113.366 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -81.42 -33.55 32.1 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.418 0.687 . . . . 0.0 111.94 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.5 tp -65.94 -40.2 91.15 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.632 1.173 . . . . 0.0 111.929 169.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -60.94 -32.39 71.9 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.269 -0.894 . . . . 0.0 112.123 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.0 ttt85 -68.34 -41.88 80.11 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 124.189 0.995 . . . . 0.0 112.556 172.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -64.09 -34.87 79.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.745 0.818 . . . . 0.0 112.032 174.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.1 mt -72.62 -48.66 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 121.221 -0.924 . . . . 0.0 111.638 175.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 16.6 m0 -53.75 -28.41 34.36 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.523 0.729 . . . . 0.0 112.852 173.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.46 -37.84 74.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.484 0.714 . . . . 0.0 112.681 175.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -69.8 -34.05 73.19 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.438 0.695 . . . . 0.0 112.267 171.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -72.5 -4.77 32.47 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.09 23.68 73.67 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.595 1.093 . . . . 0.0 115.063 175.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.6 t -67.02 141.55 17.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.749 1.219 . . . . 0.0 111.124 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.7 mttt . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.193 1.797 . . . . 0.0 111.787 -179.76 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 m -74.75 -17.58 60.62 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -173.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 t -150.81 156.5 41.37 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.331 1.452 . . . . 0.0 111.706 177.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.84 68.08 2.84 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 125.406 1.479 . . . . 0.0 112.996 177.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.4 p -72.47 168.87 17.61 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.905 1.282 . . . . 0.0 113.652 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 m -75.83 2.39 12.45 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.97 176.17 33.78 Favored Glycine 0 CA--C 1.538 1.511 0 C-N-CA 125.165 1.364 . . . . 0.0 114.535 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.29 146.54 50.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.003 1.321 . . . . 0.0 111.628 -178.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.02 175.39 9.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.876 1.271 . . . . 0.0 113.831 -174.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.26 170.99 14.73 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.691 1.996 . . . . 0.0 111.19 178.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -113.37 135.24 54.08 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.793 1.637 . . . . 0.0 111.416 176.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.7 t -56.68 141.1 74.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.571 1.548 . . . . 0.0 113.032 -169.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -73.04 -3.32 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.517 2.145 . . . . 0.0 113.94 179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -126.28 -25.71 3.46 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.2 p -138.5 -177.01 4.66 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.458 1.103 . . . . 0.0 113.519 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -81.27 -6.14 58.55 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -81.7 151.53 27.48 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -105.31 147.9 27.63 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.299 1.44 . . . . 0.0 113.788 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -136.26 149.35 48.45 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.649 1.18 . . . . 0.0 111.202 169.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 26.7 ptm -74.75 171.36 14.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.061 0.944 . . . . 0.0 112.884 175.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -63.34 16.65 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 117.436 2.384 . . . . 0.0 117.436 -179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -75.61 -17.67 59.94 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.46 -60.75 2.39 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.507 1.527 . . . . 0.0 114.432 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 m -64.27 -37.93 89.22 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -169.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -75.3 -31.93 60.82 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.518 -0.739 . . . . 0.0 111.923 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 50.7 tp -69.81 -42.44 73.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.093 0.957 . . . . 0.0 111.701 169.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -58.4 -45.55 88.15 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.845 0.858 . . . . 0.0 111.469 -178.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -68.64 -31.65 70.94 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.7 t60 -68.66 -37.18 79.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.595 0.758 . . . . 0.0 112.555 173.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 74.9 mt -72.36 -47.09 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 O-C-N 121.021 -1.049 . . . . 0.0 111.221 175.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 27.7 m0 -52.7 -30.31 31.53 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.377 0.671 . . . . 0.0 112.655 171.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.99 68.17 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 176.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -65.76 -34.08 77.35 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.873 0.76 . . . . 0.0 112.079 170.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -73.73 -0.39 15.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.929 1.292 . . . . 0.0 113.895 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.77 14.81 82.17 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.083 1.325 . . . . 0.0 115.368 174.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.0 t -77.56 134.5 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.926 1.291 . . . . 0.0 110.671 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.615 1.966 . . . . 0.0 111.413 178.751 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.537 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 t -148.41 156.16 42.14 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.259 1.423 . . . . 0.0 111.649 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.4 p -150.1 161.4 42.44 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.449 1.5 . . . . 0.0 112.65 -178.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.61 179.88 48.8 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.841 1.21 . . . . 0.0 113.215 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.5 t -148.83 149.36 31.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.963 1.305 . . . . 0.0 111.799 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.3 m 55.7 22.35 5.32 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.376 1.87 . . . . 0.0 115.975 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 141.0 30.01 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.297 0.951 . . . . 0.0 113.017 177.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 45.6 ttp85 -133.95 13.29 3.97 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.168 1.387 . . . . 0.0 113.927 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.88 160.64 31.12 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.417 1.087 . . . . 0.0 112.812 177.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -82.88 128.82 34.78 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.066 1.346 . . . . 0.0 109.814 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -96.07 129.07 43.45 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.39 0.995 . . . . 0.0 111.473 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 20.7 t -52.8 137.33 44.7 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 123.947 0.899 . . . . 0.0 111.744 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -70.56 -2.91 11.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.915 2.41 . . . . 0.0 114.226 -178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -126.62 -25.17 3.45 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.9 p -140.14 -179.3 5.9 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.83 1.37 50.05 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -173.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -76.83 139.85 40.46 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.248 -0.908 . . . . 0.0 113.149 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -95.97 149.1 21.95 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -141.03 169.01 18.42 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.849 2.06 . . . . 0.0 112.336 -175.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -118.89 167.25 11.89 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.548 1.939 . . . . 0.0 109.156 169.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -71.39 40.19 0.06 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.884 2.074 . . . . 0.0 113.859 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.1 55.13 2.71 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.543 1.937 . . . . 0.0 111.951 -173.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.04 -124.2 33.48 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 124.703 1.144 . . . . 0.0 113.624 175.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.4 p -72.82 -8.39 55.27 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -67.75 -29.44 68.66 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.685 1.13 . . . . 0.0 113.421 -176.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.6 tp -81.28 -40.21 24.06 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.74 0.816 . . . . 0.0 111.006 168.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -61.02 -43.87 98.25 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 111.537 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -62.01 -33.84 75.09 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.941 0.896 . . . . 0.0 113.357 176.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -73.2 -36.67 66.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.152 0.981 . . . . 0.0 111.962 176.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.2 mt -72.64 -48.46 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 121.283 -0.885 . . . . 0.0 111.553 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -54.39 -27.78 38.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.924 0.889 . . . . 0.0 112.644 174.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.39 -39.5 67.94 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 174.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -66.63 -34.47 77.94 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.701 0.682 . . . . 0.0 112.092 171.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.11 -7.28 51.98 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.388 1.075 . . . . 0.0 113.748 172.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.42 25.55 74.03 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.536 1.065 . . . . 0.0 114.847 177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 76.2 t -62.53 139.13 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.273 1.429 . . . . 0.0 111.34 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.953 1.701 . . . . 0.0 112.33 -176.036 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.607 0 N-CA-C 111.303 -0.719 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 m 56.01 28.27 12.53 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 175.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 t -151.23 152.77 33.73 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.411 1.484 . . . . 0.0 111.64 179.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 170.4 179.23 41.72 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 125.189 1.376 . . . . 0.0 113.146 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.4 m 51.99 38.94 25.15 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.518 1.527 . . . . 0.0 114.733 175.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.3 t -140.34 165.59 27.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.46 1.504 . . . . 0.0 112.321 -176.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.83 179.72 40.82 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 125.239 1.4 . . . . 0.0 114.956 -178.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.3 ptt180 -77.24 45.73 0.47 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.516 1.926 . . . . 0.0 114.459 -176.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 155.72 29.98 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.745 1.218 . . . . 0.0 113.285 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -77.02 135.91 38.68 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 125.764 1.626 . . . . 0.0 109.717 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -108.93 131.72 54.77 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.509 1.124 . . . . 0.0 111.952 171.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 32.1 t -54.51 138.38 60.27 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.519 1.127 . . . . 0.0 112.011 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.33 -2.77 12.21 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 122.913 2.409 . . . . 0.0 114.151 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -124.86 -28.0 3.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.8 p -138.1 -179.47 5.8 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -87.95 7.92 28.77 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -78.24 141.62 38.45 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.127 -0.983 . . . . 0.0 112.829 175.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.04 153.77 21.57 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.468 1.507 . . . . 0.0 114.068 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -130.0 140.09 50.94 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.714 1.606 . . . . 0.0 110.494 173.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.5 ppp? -99.56 0.08 41.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.025 1.33 . . . . 0.0 113.824 176.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -146.08 142.72 28.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.883 1.673 . . . . 0.0 111.497 -172.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -92.5 147.98 22.46 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.479 1.111 . . . . 0.0 111.444 169.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.68 -158.38 30.56 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.439 1.019 . . . . 0.0 112.457 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 85.0 p -75.59 -25.54 57.11 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -64.34 -41.0 96.99 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.322 -0.861 . . . . 0.0 112.881 -173.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 59.0 tp -66.87 -38.1 85.67 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.095 0.558 . . . . 0.0 111.627 172.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -65.31 -43.63 90.45 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.64 -0.663 . . . . 0.0 111.279 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.4 mtm-85 -61.16 -43.51 98.77 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-N 118.807 0.73 . . . . 0.0 112.158 171.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -60.31 -37.6 81.09 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.343 0.657 . . . . 0.0 112.372 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.1 mt -74.4 -49.3 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.033 0.933 . . . . 0.0 111.786 175.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -54.01 -30.14 46.28 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 112.388 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.8 78.13 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.314 1.045 . . . . 0.0 113.134 174.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -67.88 -32.0 72.19 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.943 0.792 . . . . 0.0 112.075 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.5 0.76 13.71 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.327 1.051 . . . . 0.0 113.705 169.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.23 11.58 84.16 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.119 1.342 . . . . 0.0 115.467 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 35.0 t -79.62 136.65 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.798 1.239 . . . . 0.0 110.474 179.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 C--O 1.251 1.168 0 C-N-CA 126.489 1.916 . . . . 0.0 111.581 179.97 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.504 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.7 p -63.7 -14.68 54.42 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.761 1.225 . . . . 0.0 114.189 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.2 p -67.25 -16.17 64.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.977 2.111 . . . . 0.0 114.514 169.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -68.4 154.24 53.14 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.554 1.074 . . . . 0.0 113.958 178.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.0 t -150.56 151.1 32.09 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.979 1.312 . . . . 0.0 112.088 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 48.2 p -78.33 -12.12 59.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.278 1.431 . . . . 0.0 113.488 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.54 -124.86 35.75 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.277 0.941 . . . . 0.0 112.634 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 93.5 mtm-85 -84.73 -6.67 59.36 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.836 1.254 . . . . 0.0 114.267 177.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -103.26 173.05 6.48 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.214 1.406 . . . . 0.0 113.17 -174.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.2 tmm? -116.71 132.87 56.58 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.438 1.895 . . . . 0.0 109.302 -177.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -98.51 128.55 44.9 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.513 1.051 . . . . 0.0 111.917 175.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 17.4 t -53.84 139.51 51.95 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 124.483 1.113 . . . . 0.0 112.24 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -72.67 -2.42 11.83 Favored 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 122.732 2.288 . . . . 0.0 114.214 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -125.37 -26.48 3.6 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.8 p -138.77 177.36 7.94 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -83.6 0.88 44.83 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 -174.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -80.47 145.28 31.98 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.255 -0.903 . . . . 0.0 113.285 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -101.23 151.86 21.35 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.149 1.38 . . . . 0.0 114.6 -178.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -128.53 160.65 31.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.996 2.118 . . . . 0.0 111.274 174.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.94 159.68 43.26 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.417 1.487 . . . . 0.0 110.97 -176.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 52.54 -114.23 0.82 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.451 1.9 . . . . 0.0 113.301 176.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -73.87 128.01 34.37 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.336 1.054 . . . . 0.0 112.348 -171.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.91 1.39 59.1 Favored Glycine 0 CA--C 1.536 1.388 0 C-N-CA 125.067 1.318 . . . . 0.0 115.543 178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 71.3 p -60.1 -37.45 80.02 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.377 1.588 . . . . 0.0 113.365 178.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -81.81 -34.11 30.43 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.108 0.963 . . . . 0.0 112.495 176.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.7 tp -62.35 -41.98 99.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.77 0.828 . . . . 0.0 111.786 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -59.33 -46.1 89.54 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.908 -0.495 . . . . 0.0 111.784 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 70.0 mtm-85 -64.31 -41.08 97.0 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.234 0.614 . . . . 0.0 112.237 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -62.24 -37.75 86.6 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.716 0.806 . . . . 0.0 112.61 175.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.4 mt -73.39 -48.46 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 O-C-N 121.098 -1.001 . . . . 0.0 111.596 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 30.2 m0 -54.25 -28.89 44.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.531 0.732 . . . . 0.0 112.374 174.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.22 -39.3 71.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.813 0.845 . . . . 0.0 113.03 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -66.1 -34.41 77.99 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.444 -0.785 . . . . 0.0 112.085 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -73.67 -4.42 34.24 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 171.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.54 21.56 78.57 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.648 1.118 . . . . 0.0 115.057 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.64 136.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 124.874 1.269 . . . . 0.0 110.785 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt . . . . . 0 C--O 1.253 1.244 0 C-N-CA 125.323 1.449 . . . . 0.0 112.723 -179.245 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.7 p -80.18 167.83 19.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.895 1.278 . . . . 0.0 113.133 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 71.2 m -78.08 -10.19 59.5 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 177.6 156.1 15.47 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.663 1.602 . . . . 0.0 112.194 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 61.1 p -65.77 -22.84 66.61 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -174.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 86.4 p -83.8 -13.62 53.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.542 1.537 . . . . 0.0 113.959 172.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 70.14 10.81 66.2 Favored Glycine 0 CA--C 1.54 1.613 0 C-N-CA 124.503 1.049 . . . . 0.0 114.51 -169.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 95.3 mtm-85 -132.91 162.74 30.8 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.965 1.706 . . . . 0.0 112.544 -173.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -148.01 161.43 41.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.7 1.6 . . . . 0.0 111.546 173.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 tmm? -83.55 130.08 34.99 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.707 1.603 . . . . 0.0 109.887 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -95.99 127.83 42.35 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 119.363 0.983 . . . . 0.0 111.752 174.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.3 t -51.96 138.19 35.03 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.37 1.068 . . . . 0.0 111.912 179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -73.03 -1.35 10.39 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.405 2.07 . . . . 0.0 114.065 -178.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -125.77 -23.96 3.91 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.887 1.275 . . . . 0.0 114.342 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.6 p -142.17 -177.27 5.16 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -85.51 3.92 38.19 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -177.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -79.66 141.68 36.24 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.176 -0.952 . . . . 0.0 113.002 -178.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -101.87 148.97 24.68 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -178.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -134.18 156.01 49.11 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.797 2.039 . . . . 0.0 111.422 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 12.0 tpt -151.34 135.67 16.85 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.081 0.953 . . . . 0.0 110.88 174.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 99.0 mttt 57.73 -40.37 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 129.401 3.08 . . . . 0.0 117.968 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -82.27 80.27 8.52 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.854 1.206 . . . . 0.0 112.305 -174.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.65 -26.89 70.24 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.19 0.9 . . . . 0.0 114.152 177.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.4 m -70.85 -44.08 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.661 1.231 . . . . 0.0 112.307 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -71.92 -32.97 67.89 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.663 -0.648 . . . . 0.0 111.888 176.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.9 tp -62.04 -46.61 88.41 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.219 0.608 . . . . 0.0 111.24 169.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -61.0 -41.54 96.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.525 0.73 . . . . 0.0 111.376 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -62.27 -42.89 99.73 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.085 0.954 . . . . 0.0 112.328 172.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -65.13 -36.02 82.94 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.281 1.032 . . . . 0.0 112.713 176.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 72.1 mt -71.8 -47.07 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 O-C-N 120.814 -1.179 . . . . 0.0 111.625 175.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.4 m0 -54.56 -27.8 41.35 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.555 0.742 . . . . 0.0 112.689 171.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.91 -38.82 64.21 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.487 -0.758 . . . . 0.0 112.813 175.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -64.88 -37.17 86.74 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 118.822 0.737 . . . . 0.0 112.008 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -74.5 -4.25 35.67 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 114.278 173.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.99 27.08 74.24 Favored Glycine 0 CA--C 1.538 1.479 0 C-N-CA 124.37 0.985 . . . . 0.0 114.725 175.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.62 137.53 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 125.035 1.334 . . . . 0.0 111.229 -176.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.2 pttp . . . . . 0 C--O 1.254 1.338 0 C-N-CA 126.385 1.874 . . . . 0.0 112.724 -178.652 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.26 -0.336 . . . . 0.0 112.26 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.2 m -89.31 7.96 32.97 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.187 1.395 . . . . 0.0 114.761 -174.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.4 p -71.77 158.27 36.42 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.35 1.46 . . . . 0.0 113.588 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 73.94 -172.03 51.72 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.466 1.032 . . . . 0.0 114.038 -175.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 98.2 p -150.1 161.06 43.1 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.953 1.301 . . . . 0.0 112.623 179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.7 m -96.39 0.24 50.28 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.018 1.327 . . . . 0.0 114.314 -176.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.96 164.12 54.32 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 124.527 1.06 . . . . 0.0 114.307 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 39.6 ptt85 -83.46 0.74 44.96 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -177.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.48 174.74 7.0 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.643 1.177 . . . . 0.0 113.871 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 157.59 30.65 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.955 1.702 . . . . 0.0 110.978 174.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tttp -114.28 137.3 51.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.547 1.539 . . . . 0.0 111.29 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 43.6 t -57.13 138.73 79.88 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 125.765 1.626 . . . . 0.0 112.383 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -73.37 -2.89 12.77 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 122.493 2.128 . . . . 0.0 113.83 178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -126.43 -26.52 3.29 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 11.4 p -138.57 -171.69 3.12 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -79.04 -14.91 58.89 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.111 1.364 . . . . 0.0 113.87 -176.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -73.88 155.84 38.31 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -118.16 152.71 35.12 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.681 1.592 . . . . 0.0 113.916 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -132.53 149.14 52.37 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.679 1.191 . . . . 0.0 111.728 168.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -138.88 -1.07 1.83 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.467 1.507 . . . . 0.0 114.564 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -142.64 149.23 38.64 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.41 1.884 . . . . 0.0 111.193 173.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 55.0 t30 51.18 117.97 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 129.305 3.042 . . . . 0.0 116.996 178.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.44 82.63 Favored Glycine 0 CA--C 1.536 1.378 0 O-C-N 121.178 -0.952 . . . . 0.0 114.682 175.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.9 p -78.58 -20.97 49.33 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.801 1.8 . . . . 0.0 114.025 -177.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -72.38 -35.47 68.47 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.364 -0.835 . . . . 0.0 111.333 169.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.79 -43.85 71.3 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.708 -0.62 . . . . 0.0 111.198 169.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -60.79 -43.44 98.1 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.611 -0.681 . . . . 0.0 111.804 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -69.97 -32.21 70.31 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 175.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 t60 -66.37 -37.37 85.13 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.767 0.827 . . . . 0.0 111.992 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.25 -47.31 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 O-C-N 121.1 -1.0 . . . . 0.0 111.552 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 23.3 m0 -54.21 -27.78 36.59 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.609 0.764 . . . . 0.0 112.902 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.29 -38.03 68.85 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.556 -0.715 . . . . 0.0 112.795 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -67.47 -35.22 78.75 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.591 -0.693 . . . . 0.0 112.075 171.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -73.84 -3.35 28.17 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.82 1.248 . . . . 0.0 114.131 171.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.37 25.16 75.96 Favored Glycine 0 CA--C 1.536 1.378 0 C-N-CA 124.487 1.042 . . . . 0.0 114.915 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.78 138.12 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.877 1.271 . . . . 0.0 111.09 -178.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.555 1.942 . . . . 0.0 111.555 178.773 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.659 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 m -66.42 152.44 45.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.428 1.091 . . . . 0.0 113.059 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.9 p -73.69 150.83 40.98 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.548 1.139 . . . . 0.0 113.267 178.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.75 177.39 52.36 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.747 1.165 . . . . 0.0 114.317 177.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 36.6 t -71.18 152.38 43.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.342 1.057 . . . . 0.0 112.426 174.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.6 p -73.6 -16.18 61.25 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.704 1.201 . . . . 0.0 113.398 170.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 59.95 -116.77 9.53 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 124.324 0.964 . . . . 0.0 112.977 174.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 58.6 ttm-85 -82.1 -9.58 59.48 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.203 1.401 . . . . 0.0 114.573 -178.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.14 172.67 12.43 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.31 169.5 17.37 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.73 1.612 . . . . 0.0 110.236 169.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.0 tttt -112.91 140.22 47.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.364 1.066 . . . . 0.0 111.341 170.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 37.4 t -58.31 137.69 84.98 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.735 1.214 . . . . 0.0 111.578 -178.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -72.28 -3.37 13.21 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 122.999 2.466 . . . . 0.0 114.199 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -126.42 -27.33 3.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.2 p -135.57 -179.3 5.56 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -78.25 -2.41 37.73 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.866 1.267 . . . . 0.0 114.025 -175.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -83.77 154.11 23.75 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -170.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -118.6 148.01 43.13 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 126.026 1.73 . . . . 0.0 113.113 -178.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -135.47 164.46 27.75 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.361 1.464 . . . . 0.0 110.382 168.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -144.69 136.22 25.51 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.287 1.435 . . . . 0.0 109.816 -179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . 0.265 63.5 pttt 51.96 -29.77 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 131.016 3.727 . . . . 0.0 119.422 -176.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -81.73 60.36 4.62 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.692 1.597 . . . . 0.0 112.595 -177.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.02 -34.41 65.88 Favored Glycine 0 CA--C 1.536 1.368 0 O-C-N 121.283 -0.885 . . . . 0.0 113.795 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.0 m -65.3 -20.47 66.42 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.602 1.161 . . . . 0.0 113.92 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.47 -34.39 12.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.198 1.399 . . . . 0.0 112.266 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 67.6 tp -58.55 -39.76 81.11 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.013 0.925 . . . . 0.0 111.963 173.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -56.21 -40.78 74.58 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.865 -0.522 . . . . 0.0 111.98 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -66.19 -43.68 86.15 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.108 0.963 . . . . 0.0 111.411 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -61.77 -36.98 82.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.032 0.933 . . . . 0.0 112.32 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 76.7 mt -75.18 -49.39 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 O-C-N 121.313 -0.867 . . . . 0.0 111.783 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -55.5 -27.65 49.84 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.325 0.65 . . . . 0.0 112.478 174.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -39.17 73.16 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.717 0.807 . . . . 0.0 112.923 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -66.77 -33.69 76.17 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 118.943 0.792 . . . . 0.0 112.173 171.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -74.18 -3.28 28.82 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 171.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.8 21.29 78.79 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 124.694 1.14 . . . . 0.0 115.104 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.4 t -70.12 137.79 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.747 1.219 . . . . 0.0 110.899 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.091 0 C-N-CA 126.075 1.75 . . . . 0.0 112.997 176.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.63 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 p -76.56 160.71 29.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.753 1.221 . . . . 0.0 113.284 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.4 t -148.87 165.76 30.56 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.325 1.45 . . . . 0.0 111.601 178.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.5 154.57 52.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 124.597 1.094 . . . . 0.0 114.214 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 68.9 p -87.78 -5.27 58.72 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 -177.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.9 m -63.03 145.97 54.26 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.159 1.384 . . . . 0.0 113.432 -177.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 179.84 174.96 46.2 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.727 1.156 . . . . 0.0 113.376 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -109.5 5.42 23.24 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.477 1.511 . . . . 0.0 114.467 -176.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.22 161.72 27.94 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -172.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -115.24 139.58 49.83 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.49 2.716 . . . . 0.0 108.681 177.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -109.91 130.56 55.51 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.938 1.295 . . . . 0.0 112.717 174.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 35.0 t -54.97 140.06 62.07 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.336 1.455 . . . . 0.0 112.599 -176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -75.34 -3.53 14.02 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.865 2.377 . . . . 0.0 114.135 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -123.84 -29.37 3.69 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.3 p -134.13 -178.47 5.05 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -76.47 -16.77 59.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.497 1.119 . . . . 0.0 113.915 -175.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.55 150.79 45.73 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -168.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -108.01 153.25 23.36 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.609 1.564 . . . . 0.0 115.189 -176.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -133.8 151.77 51.67 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.726 1.61 . . . . 0.0 111.518 170.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.2 ttp -81.96 -31.32 31.28 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.428 0.691 . . . . 0.0 110.819 167.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -88.29 164.56 15.52 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.528 1.931 . . . . 0.0 113.236 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -135.62 168.72 18.74 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.097 2.159 . . . . 0.0 108.932 169.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.31 -139.75 23.64 Favored Glycine 0 CA--C 1.533 1.171 0 O-C-N 121.09 -1.006 . . . . 0.0 113.419 -179.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 m -50.89 -42.22 59.01 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 116.026 1.862 . . . . 0.0 116.026 -168.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -75.44 -30.26 59.96 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 119.619 1.099 . . . . 0.0 113.325 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.0 tp -72.52 -35.4 68.09 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.811 0.844 . . . . 0.0 110.88 169.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.32 -29.28 68.76 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.403 -0.81 . . . . 0.0 112.379 -178.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -56.36 -45.63 80.39 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.172 1.389 . . . . 0.0 112.446 171.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -74.73 -32.47 62.12 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.066 1.347 . . . . 0.0 112.343 179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.6 mt -72.13 -47.76 52.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 121.253 -0.905 . . . . 0.0 111.42 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 10.1 m0 -52.66 -29.08 24.39 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 112.94 172.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -37.41 73.03 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.52 0.728 . . . . 0.0 112.556 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -70.69 -32.91 70.32 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.582 0.753 . . . . 0.0 112.401 171.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.3 -3.44 23.79 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 78.41 18.56 75.77 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 124.759 1.171 . . . . 0.0 115.317 174.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 46.5 t -69.47 135.83 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 118.589 1.195 . . . . 0.0 110.413 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.458 1.903 . . . . 0.0 111.296 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.643 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.4 m -67.42 149.91 49.62 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.542 1.137 . . . . 0.0 113.108 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.3 m -67.34 143.07 56.56 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.397 1.079 . . . . 0.0 112.761 -179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.88 -2.11 90.64 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.623 1.106 . . . . 0.0 115.588 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.5 m -67.62 148.0 51.97 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.195 1.398 . . . . 0.0 113.659 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 67.6 m -137.29 151.73 48.99 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.699 1.6 . . . . 0.0 111.835 178.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.83 -174.42 47.03 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.768 1.175 . . . . 0.0 113.09 179.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -141.02 145.79 36.37 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.711 1.604 . . . . 0.0 111.406 175.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -152.85 176.79 11.43 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.758 1.623 . . . . 0.0 111.641 175.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.4 156.73 27.42 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.881 1.672 . . . . 0.0 110.739 173.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -116.98 139.69 50.36 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.82 1.248 . . . . 0.0 111.504 172.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 41.9 t -56.96 137.35 79.67 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.874 1.27 . . . . 0.0 111.993 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -69.83 -3.68 12.54 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.086 2.524 . . . . 0.0 114.045 178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.48 -28.9 2.73 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -178.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.7 p -136.75 -173.72 3.51 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -82.79 -5.07 58.76 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.807 1.243 . . . . 0.0 114.272 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -78.96 150.87 31.92 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -174.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -115.45 151.55 34.55 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.96 1.704 . . . . 0.0 113.157 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -135.19 148.33 49.65 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.475 1.51 . . . . 0.0 109.382 169.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 27.8 ttt -83.45 125.83 32.12 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.39 -0.819 . . . . 0.0 109.835 169.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt 55.33 -179.46 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.179 1.791 . . . . 0.0 113.621 -172.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -83.73 156.19 22.7 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.039 0.935 . . . . 0.0 110.392 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -178.2 172.02 44.47 Favored Glycine 0 CA--C 1.532 1.108 0 O-C-N 121.379 -0.826 . . . . 0.0 114.318 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.0 p -63.22 -36.78 84.77 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.942 0.897 . . . . 0.0 113.187 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -72.52 -28.4 62.83 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.086 -1.009 . . . . 0.0 112.716 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 57.7 tp -69.54 -39.75 77.28 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.824 -0.548 . . . . 0.0 110.445 168.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -60.94 -41.01 95.45 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.419 -0.8 . . . . 0.0 111.532 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -58.99 -50.8 72.7 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.126 0.97 . . . . 0.0 112.011 169.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 55.9 t60 -58.12 -37.51 74.74 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.389 1.076 . . . . 0.0 112.584 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.8 mt -74.4 -50.0 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 124.083 0.953 . . . . 0.0 111.796 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.7 m0 -51.55 -32.75 29.39 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.231 0.612 . . . . 0.0 112.598 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.17 84.83 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.241 1.017 . . . . 0.0 112.918 175.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -71.74 -29.54 64.62 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.503 0.721 . . . . 0.0 112.631 171.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.04 -4.03 39.09 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 173.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.11 36.78 56.25 Favored Glycine 0 CA--C 1.535 1.316 0 O-C-N 121.241 -0.912 . . . . 0.0 113.74 178.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.7 p -52.87 146.43 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 125.574 1.55 . . . . 0.0 113.385 178.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.3 mttt . . . . . 0 C--O 1.254 1.328 0 C-N-CA 126.322 1.849 . . . . 0.0 111.909 -177.636 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_