data_6d9p_residue ############################ # Computer software used # ############################ 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 6d9p _Structure_validation_residue.Date_analyzed 2019-05-03 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.6 m . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.01 68.67 8.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.536 -0.728 . . . . 0.0 110.1 166.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.9 tp -50.54 -32.21 17.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.63 1.572 . . . . 0.0 113.379 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -59.01 -54.26 49.15 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.931 0.892 . . . . 0.0 112.191 171.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -67.61 -28.68 67.95 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.152 0.887 . . . . 0.0 112.471 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.6 m -66.31 -46.47 76.8 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 124.691 1.197 . . . . 0.0 112.163 170.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.97 -43.1 86.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.36 -0.829 . . . . 0.0 112.346 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.65 -50.52 72.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.118 0.872 . . . . 0.0 111.828 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.7 m -62.73 -41.31 99.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.495 0.718 . . . . 0.0 112.212 -176.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.0 m -77.8 -21.66 51.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 176.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -59.68 -36.04 75.68 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 120.074 1.307 . . . . 0.0 111.842 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -61.9 -24.85 67.2 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.1 mt -93.93 -4.47 49.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.814 1.646 . . . . 0.0 112.765 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.35 14.32 60.36 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.086 1.803 . . . . 0.0 116.333 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.23 178.8 8.65 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 119.872 1.836 . . . . 0.0 114.595 -172.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.9 mt -72.09 168.91 17.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.524 1.53 . . . . 0.0 112.144 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.84 59.97 0.64 Allowed Glycine 0 N--CA 1.474 1.197 0 C-N-CA 126.306 1.908 . . . . 0.0 113.868 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -66.06 148.67 51.46 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.57 1.948 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.4 t -86.35 120.09 27.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.727 0.811 . . . . 0.0 111.709 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -131.8 112.71 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.079 1.352 . . . . 0.0 109.509 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.45 39.54 97.83 Favored Glycine 0 CA--C 1.535 1.288 0 O-C-N 121.426 -0.796 . . . . 0.0 112.659 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.61 22.13 12.57 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.052 1.741 . . . . 0.0 115.352 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -139.33 149.15 43.87 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.123 1.769 . . . . 0.0 110.296 167.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.4 m -79.45 156.97 27.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -150.72 138.43 19.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.921 1.689 . . . . 0.0 110.599 171.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.8 m -82.6 129.99 35.04 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 111.745 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.4 m -148.97 155.79 40.53 Favored Pre-proline 0 N--CA 1.484 1.244 0 C-N-CA 125.859 1.664 . . . . 0.0 113.472 -173.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -67.43 163.2 35.64 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.888 3.059 . . . . 0.0 115.231 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 127.243 2.217 . . . . 0.0 114.321 177.08 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 CA--C 1.552 1.048 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -92.68 87.51 5.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.743 1.617 . . . . 0.0 108.896 168.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.8 tp -67.42 -38.68 84.97 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.755 0.822 . . . . 0.0 112.804 -170.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -65.23 -42.74 93.09 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.655 1.116 . . . . 0.0 112.333 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -55.3 -41.92 72.99 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.369 0.986 . . . . 0.0 111.845 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -64.57 -50.07 68.7 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.372 0.669 . . . . 0.0 111.531 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.02 -42.05 93.48 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.745 -1.222 . . . . 0.0 113.725 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.83 -48.97 72.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.639 1.109 . . . . 0.0 111.775 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 79.1 p -67.35 -32.57 73.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.07 -29.13 62.73 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.491 1.041 . . . . 0.0 113.359 170.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.87 -38.74 89.44 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.848 -1.158 . . . . 0.0 111.424 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -56.05 -33.2 64.77 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.659 0.783 . . . . 0.0 112.266 173.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.5 mt -84.71 -13.34 51.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.166 1.387 . . . . 0.0 112.751 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.83 23.18 13.99 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.577 -1.124 . . . . 0.0 115.829 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -155.31 176.12 12.99 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.01 1.405 . . . . 0.0 113.433 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.82 169.74 17.76 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.301 1.441 . . . . 0.0 113.436 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.89 134.52 9.93 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 110.618 167.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -125.04 136.99 54.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.756 1.622 . . . . 0.0 113.384 172.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.53 127.36 32.44 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.896 1.678 . . . . 0.0 110.376 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -87.71 -31.34 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.119 1.368 . . . . 0.0 111.831 176.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.93 -102.54 0.19 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 128.114 2.768 . . . . 0.0 110.988 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -74.83 -21.98 58.96 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.801 -0.823 . . . . 0.0 112.698 171.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.59 167.52 11.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.6 1.96 . . . . 0.0 110.918 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 152.49 47.81 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.257 1.423 . . . . 0.0 111.284 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.29 154.99 43.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.3 m -79.48 137.59 37.27 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -149.59 156.29 38.97 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 126.078 1.751 . . . . 0.0 112.302 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -62.69 168.65 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.93 3.087 . . . . 0.0 115.23 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.249 1.054 0 C-N-CA 126.664 1.986 . . . . 0.0 112.342 174.049 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.2 t . . . . . 0 CA--C 1.541 0.628 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -74.85 69.8 1.88 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.536 1.135 . . . . 0.0 112.341 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.13 -45.23 75.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.709 1.603 . . . . 0.0 112.568 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -61.21 -47.23 87.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.387 0.675 . . . . 0.0 112.129 178.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 -58.79 -40.71 84.81 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.375 0.67 . . . . 0.0 111.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.06 -50.29 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.61 1.164 . . . . 0.0 112.691 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -59.81 -38.14 81.14 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.633 -1.292 . . . . 0.0 113.2 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.36 -34.59 78.5 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.032 0.833 . . . . 0.0 112.395 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.1 t -65.55 -45.55 82.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.459 0.304 . . . . 0.0 111.7 170.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.4 m -70.19 -28.38 65.26 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mtp180 -58.62 -32.49 69.07 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.663 1.185 . . . . 0.0 113.161 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -78.3 0.51 25.12 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 175.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.4 mt -123.83 -3.19 8.21 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 127.147 2.179 . . . . 0.0 113.577 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 13.67 58.92 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.62 1.581 . . . . 0.0 116.969 173.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -145.72 -179.58 6.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.826 1.813 . . . . 0.0 114.54 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 69.0 mt -83.08 169.87 15.42 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.385 1.474 . . . . 0.0 112.825 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.89 129.41 6.56 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.01 1.291 . . . . 0.0 112.038 169.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -124.04 141.81 51.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.962 1.305 . . . . 0.0 113.5 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 99.4 m -81.73 146.06 30.17 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.448 1.499 . . . . 0.0 112.505 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -103.74 -26.61 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-O 123.466 1.603 . . . . 0.0 112.804 -177.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.34 -48.92 0.21 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 128.08 2.752 . . . . 0.0 111.832 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -139.18 -18.55 1.0 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 169.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -101.53 166.94 10.45 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.589 1.555 . . . . 0.0 110.614 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.5 t -136.17 160.31 39.05 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.986 1.314 . . . . 0.0 112.673 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.29 150.28 35.45 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.341 1.456 . . . . 0.0 112.181 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.7 m -81.03 136.31 35.96 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -149.72 154.05 37.16 Favored Pre-proline 0 N--CA 1.481 1.086 0 C-N-CA 126.108 1.763 . . . . 0.0 113.256 -169.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.93 164.1 36.5 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.284 3.323 . . . . 0.0 113.949 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 C--O 1.258 1.502 0 C-N-CA 126.232 1.813 . . . . 0.0 113.946 -177.053 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.3 m . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.36 73.17 7.25 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 166.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.7 tp -57.95 -38.63 76.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -167.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -58.98 -52.48 65.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.259 0.936 . . . . 0.0 110.996 172.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -57.1 -42.54 80.96 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 118.913 0.779 . . . . 0.0 112.79 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 89.4 m -63.62 -38.7 92.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.258 1.023 . . . . 0.0 112.691 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -62.43 -46.99 86.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.121 -0.987 . . . . 0.0 112.564 171.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 77.0 mt -58.5 -44.25 89.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.111 0.869 . . . . 0.0 111.06 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.9 m -57.22 -54.52 45.85 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.123 0.969 . . . . 0.0 112.234 174.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.3 m -63.16 -37.61 87.9 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.46 1.027 . . . . 0.0 112.794 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -63.81 -23.8 67.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.599 -1.313 . . . . 0.0 113.745 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 p -66.95 -28.0 67.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 169.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.8 mt -91.13 -5.29 55.28 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.945 2.098 . . . . 0.0 112.757 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.02 55.27 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 126.251 1.881 . . . . 0.0 116.741 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -132.07 177.88 7.22 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.918 1.859 . . . . 0.0 113.971 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.0 mt -78.8 163.69 25.14 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.565 1.146 . . . . 0.0 113.748 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.2 127.07 6.49 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 125.113 1.339 . . . . 0.0 113.076 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -130.87 153.31 49.27 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.141 1.776 . . . . 0.0 111.755 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.2 t -82.48 137.1 34.74 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.897 0.879 . . . . 0.0 111.0 170.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 35.1 mt -130.65 91.95 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.681 1.192 . . . . 0.0 108.714 174.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.97 55.71 25.03 Favored Glycine 0 CA--C 1.529 0.964 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.629 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 64.26 2.79 1.59 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.467 2.307 . . . . 0.0 116.421 -175.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -118.14 118.65 32.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.168 1.387 . . . . 0.0 111.733 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.7 m -62.57 146.11 52.71 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 159.5 43.28 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.305 1.842 . . . . 0.0 111.624 174.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.7 m -100.81 141.11 34.15 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.026 0.93 . . . . 0.0 112.319 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.97 146.53 52.72 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.791 1.236 . . . . 0.0 112.034 -175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -78.84 162.25 26.8 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.897 2.398 . . . . 0.0 112.073 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.257 1.458 0 C-N-CA 126.061 1.744 . . . . 0.0 114.364 178.601 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 CA--C 1.542 0.653 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -89.58 76.01 7.42 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.114 0.965 . . . . 0.0 110.066 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.62 -40.75 72.55 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.829 1.252 . . . . 0.0 112.834 -172.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -62.83 -46.99 85.33 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.383 0.992 . . . . 0.0 111.93 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -63.2 -38.39 90.97 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.232 -0.917 . . . . 0.0 111.726 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -61.1 -44.31 97.55 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.989 0.915 . . . . 0.0 112.349 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.35 -41.4 93.58 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.212 1.005 . . . . 0.0 112.618 174.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -65.66 -42.41 91.38 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.948 1.249 . . . . 0.0 111.909 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.0 t -60.52 -32.91 71.92 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.865 0.866 . . . . 0.0 112.315 175.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -81.37 -37.55 28.03 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.137 0.975 . . . . 0.0 113.1 171.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.8 tpp180 -64.13 -28.0 69.47 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 119.986 -1.697 . . . . 0.0 111.889 175.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -60.2 -22.08 62.52 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.406 1.482 . . . . 0.0 112.087 169.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -108.63 1.32 21.22 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 127.968 2.507 . . . . 0.0 113.296 174.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.82 14.06 63.66 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.837 1.684 . . . . 0.0 116.888 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -138.2 175.27 9.72 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.681 2.241 . . . . 0.0 114.6 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.1 mt -81.39 168.87 17.89 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.341 1.056 . . . . 0.0 112.015 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -129.29 140.73 11.94 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 124.918 1.247 . . . . 0.0 112.491 173.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -133.27 141.07 47.82 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.951 1.7 . . . . 0.0 111.534 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.9 t -72.37 155.39 40.2 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.677 1.591 . . . . 0.0 113.032 -176.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.9 mt -110.37 -28.0 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 125.975 1.71 . . . . 0.0 112.499 172.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 158.9 -75.19 0.2 Allowed Glycine 0 CA--C 1.53 0.987 0 C-N-CA 127.385 2.421 . . . . 0.0 111.726 174.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -94.18 -28.93 15.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.063 0.945 . . . . 0.0 112.51 169.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -106.33 177.9 4.72 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.158 1.383 . . . . 0.0 111.973 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -144.6 160.87 40.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.675 1.59 . . . . 0.0 111.561 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.39 154.73 35.05 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.975 0.91 . . . . 0.0 113.007 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.59 152.48 39.26 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.799 1.24 . . . . 0.0 113.982 -175.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -144.47 151.7 51.44 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.188 1.795 . . . . 0.0 113.006 -176.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -71.25 162.04 43.78 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.48 2.786 . . . . 0.0 112.8 170.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.486 1.514 . . . . 0.0 113.39 175.357 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.1 t . . . . . 0 CA--C 1.547 0.838 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -75.37 103.59 5.58 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.942 0.792 . . . . 0.0 110.376 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.72 -40.72 95.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.581 0.753 . . . . 0.0 111.993 -177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -43.15 91.34 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.061 0.846 . . . . 0.0 112.396 -175.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -59.82 -35.39 74.61 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.893 1.224 . . . . 0.0 111.346 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.87 -37.46 58.9 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 125.071 1.348 . . . . 0.0 113.804 176.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -58.65 -48.52 80.75 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.645 1.111 . . . . 0.0 111.268 171.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 49.0 mt -61.97 -41.35 97.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.405 1.002 . . . . 0.0 111.732 176.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 64.2 m -61.7 -39.32 91.08 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.418 0.687 . . . . 0.0 112.723 176.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.3 m -80.75 -38.72 28.18 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.163 0.892 . . . . 0.0 113.025 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.7 mmm-85 -63.54 -22.76 67.07 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.363 -1.461 . . . . 0.0 113.48 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.79 -35.27 76.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.373 0.669 . . . . 0.0 111.376 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.0 mt -86.94 -34.27 19.39 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.835 1.654 . . . . 0.0 112.176 175.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 137.53 -5.53 3.48 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 125.494 1.521 . . . . 0.0 116.236 170.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -126.93 174.39 8.87 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.366 1.583 . . . . 0.0 113.556 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 mt -72.58 162.06 29.97 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.976 0.893 . . . . 0.0 112.764 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.04 131.12 7.38 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.859 1.219 . . . . 0.0 111.253 172.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.3 142.36 50.56 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.994 1.718 . . . . 0.0 112.188 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 56.2 m -83.67 82.44 8.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.22 1.408 . . . . 0.0 111.133 170.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.03 115.46 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 O-C-N 121.447 -0.783 . . . . 0.0 109.398 -175.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.7 50.47 63.17 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 122.114 -0.367 . . . . 0.0 112.494 -176.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 55.75 26.95 10.06 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.06 144.1 27.66 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.733 -1.229 . . . . 0.0 112.301 170.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.6 m -77.17 137.82 39.1 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -170.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.46 137.75 44.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.61 1.564 . . . . 0.0 110.465 169.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -81.59 137.24 35.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.974 -0.454 . . . . 0.0 110.709 171.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -142.02 148.26 47.92 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 125.19 1.396 . . . . 0.0 111.854 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.3 164.66 33.24 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.12 2.547 . . . . 0.0 112.362 174.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.573 1.549 . . . . 0.0 112.776 -179.224 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.0 m . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -89.74 72.54 7.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.19 1.396 . . . . 0.0 109.944 169.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.29 -33.36 70.98 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -168.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -62.82 -51.65 66.23 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.504 1.047 . . . . 0.0 111.561 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -57.39 -41.74 80.83 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.162 0.892 . . . . 0.0 110.984 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.93 -46.37 81.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 124.87 1.268 . . . . 0.0 113.715 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.91 -49.69 75.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.099 0.863 . . . . 0.0 112.243 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.91 -38.09 89.82 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.159 0.891 . . . . 0.0 111.754 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -59.74 -52.75 64.17 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.492 0.717 . . . . 0.0 111.645 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.8 m -63.34 -35.35 80.09 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.189 0.904 . . . . 0.0 111.863 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -65.03 -26.15 68.14 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.385 -1.447 . . . . 0.0 113.053 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.6 p -63.96 -18.97 64.79 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.208 0.913 . . . . 0.0 112.848 169.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -107.35 -5.81 17.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.649 2.38 . . . . 0.0 113.599 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.93 16.38 30.87 Favored Glycine 0 CA--C 1.541 1.677 0 N-CA-C 117.235 1.654 . . . . 0.0 117.235 173.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -144.65 169.85 17.21 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.577 1.688 . . . . 0.0 112.868 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.1 mt -77.21 165.86 23.98 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.998 -1.064 . . . . 0.0 113.167 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.93 140.82 13.94 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.997 1.284 . . . . 0.0 111.492 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -140.47 158.67 43.66 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.579 1.952 . . . . 0.0 112.142 176.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -90.6 132.28 35.83 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.31 1.044 . . . . 0.0 112.86 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.7 mt -121.74 103.21 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.625 1.57 . . . . 0.0 108.321 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.1 48.7 81.28 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 123.896 0.76 . . . . 0.0 113.966 176.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.276 79.5 mt-10 64.44 27.3 13.56 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -175.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -146.49 143.07 28.69 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.372 -1.455 . . . . 0.0 110.792 166.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.3 m -84.66 145.36 28.02 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 -169.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.07 146.98 52.41 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.237 2.215 . . . . 0.0 111.656 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.8 m -92.0 138.53 31.46 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.51 0.724 . . . . 0.0 111.23 175.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 m -147.53 153.39 43.55 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 111.34 -169.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.8 155.71 48.73 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.942 2.428 . . . . 0.0 113.408 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.415 1.486 . . . . 0.0 113.127 169.796 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.548 0.866 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -75.59 68.25 2.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.233 1.013 . . . . 0.0 111.209 167.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 tp -49.97 -49.59 49.8 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.452 1.501 . . . . 0.0 112.958 -174.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -61.84 -38.77 89.44 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.195 0.907 . . . . 0.0 112.799 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -65.85 -38.11 87.99 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.793 -0.567 . . . . 0.0 111.895 175.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.5 m -75.43 -30.9 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.737 1.215 . . . . 0.0 113.818 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.71 -43.75 80.9 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.51 1.05 . . . . 0.0 110.916 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.3 mt -64.53 -43.71 93.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.235 1.014 . . . . 0.0 112.014 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 m -60.83 -37.88 83.54 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.78 -25.61 61.23 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.198 -0.939 . . . . 0.0 112.81 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -60.06 -39.19 85.17 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.742 -1.224 . . . . 0.0 110.903 171.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -58.68 -23.26 59.08 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.749 0.82 . . . . 0.0 112.967 173.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.48 -8.4 23.19 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.763 1.625 . . . . 0.0 113.922 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.51 33.78 13.02 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.32 1.438 . . . . 0.0 115.205 175.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.37 -178.24 7.12 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.969 1.308 . . . . 0.0 112.621 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.2 mt -85.0 168.23 15.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.596 1.158 . . . . 0.0 112.953 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.71 146.59 17.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.692 1.139 . . . . 0.0 115.056 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -138.32 163.34 32.07 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 128.146 2.578 . . . . 0.0 111.942 173.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.76 154.39 22.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 172.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mt -136.49 91.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 127.915 2.486 . . . . 0.0 105.581 166.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.8 -128.09 31.59 Favored Glycine 0 CA--C 1.536 1.352 0 O-C-N 121.456 -0.778 . . . . 0.0 111.158 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.2 mp0 -84.97 -4.99 59.35 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.974 1.31 . . . . 0.0 114.339 171.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -100.59 177.47 5.0 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.168 1.787 . . . . 0.0 112.524 175.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.3 m -121.82 161.86 21.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.915 1.286 . . . . 0.0 113.479 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.74 154.58 36.57 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.049 1.739 . . . . 0.0 111.031 169.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 54.5 m -95.28 148.69 22.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.418 0.687 . . . . 0.0 112.676 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -141.95 151.96 60.74 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 126.176 1.79 . . . . 0.0 112.411 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.23 158.42 57.73 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.993 2.462 . . . . 0.0 113.868 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.458 1.903 . . . . 0.0 112.906 176.243 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.8 t . . . . . 0 CA--C 1.544 0.735 0 CA-C-O 119.726 -0.178 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -90.81 120.16 31.62 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.778 -1.201 . . . . 0.0 110.984 174.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -74.09 -48.95 26.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.482 0.713 . . . . 0.0 112.696 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.7 ttp180 -62.74 -43.4 98.89 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.198 -0.939 . . . . 0.0 112.354 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -59.27 -37.7 78.28 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.867 0.758 . . . . 0.0 111.099 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -72.43 -36.83 68.68 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.12 1.368 . . . . 0.0 114.395 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -58.56 -47.44 84.24 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.701 1.592 . . . . 0.0 111.733 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -65.55 -36.32 83.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.17 . . . . 0.0 112.5 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -49.18 68.85 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.965 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.5 m -65.84 -23.32 66.65 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.191 -0.943 . . . . 0.0 112.772 175.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -62.33 -31.65 72.3 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.656 -1.277 . . . . 0.0 113.195 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.7 m -67.97 -26.36 65.89 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 169.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.4 mt -85.68 -7.07 59.02 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.244 1.017 . . . . 0.0 112.614 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.29 21.06 39.47 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.842 1.687 . . . . 0.0 115.575 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -149.89 -179.71 7.35 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 119.695 1.748 . . . . 0.0 113.598 -177.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.8 mt -81.37 170.65 15.73 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.161 1.384 . . . . 0.0 112.09 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.49 141.92 12.81 Favored Glycine 0 N--CA 1.472 1.06 0 C-N-CA 124.647 1.117 . . . . 0.0 113.547 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -129.19 151.34 49.96 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 127.007 2.123 . . . . 0.0 111.912 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 m -97.05 135.34 39.18 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.851 1.26 . . . . 0.0 110.672 169.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.6 mt -136.53 110.81 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.788 0.835 . . . . 0.0 109.219 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.84 -127.22 43.84 Favored Glycine 0 CA--C 1.532 1.149 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -83.33 -2.33 55.47 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -152.52 155.83 38.2 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 120.886 1.675 . . . . 0.0 115.355 -170.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -88.08 160.87 17.63 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -142.81 145.17 32.95 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.353 1.861 . . . . 0.0 111.55 168.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.5 m -91.46 143.59 26.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.718 0.807 . . . . 0.0 112.026 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.6 m -141.63 149.5 54.0 Favored Pre-proline 0 N--CA 1.48 1.059 0 C-N-CA 125.266 1.426 . . . . 0.0 112.744 -168.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.24 156.07 65.79 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.417 2.745 . . . . 0.0 113.407 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.256 1.422 . . . . 0.0 111.846 171.487 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 CA--C 1.541 0.609 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -99.73 114.3 27.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.295 1.038 . . . . 0.0 110.193 169.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -58.46 -42.64 87.91 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 tpp85 -61.42 -41.57 97.37 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.742 0.701 . . . . 0.0 112.624 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -60.26 -38.7 84.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.235 0.925 . . . . 0.0 111.454 175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.9 m -68.78 -37.8 79.57 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.939 0.896 . . . . 0.0 112.634 174.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -59.15 -45.4 91.07 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.381 1.446 . . . . 0.0 112.911 171.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.4 mt -69.63 -31.02 68.88 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.793 0.837 . . . . 0.0 112.453 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 -39.85 82.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.695 0.798 . . . . 0.0 112.344 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.5 m -71.21 -22.03 62.06 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.348 -0.845 . . . . 0.0 112.459 170.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -64.61 -30.77 71.79 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.508 -1.37 . . . . 0.0 112.225 174.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.7 m -65.69 -9.36 26.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.563 1.145 . . . . 0.0 113.473 168.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.3 mt -119.36 -6.81 10.29 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.184 2.193 . . . . 0.0 112.939 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.52 29.47 24.29 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.058 1.313 . . . . 0.0 116.039 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.87 -179.94 7.9 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.276 1.538 . . . . 0.0 113.55 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.04 176.72 7.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.03 1.732 . . . . 0.0 111.826 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.73 151.01 22.42 Favored Glycine 0 CA--C 1.533 1.164 0 N-CA-C 116.245 1.258 . . . . 0.0 116.245 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -120.83 164.93 15.88 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.478 2.311 . . . . 0.0 112.014 -177.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.1 t -123.24 129.97 52.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.001 1.72 . . . . 0.0 112.377 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -127.26 95.32 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 127.302 2.241 . . . . 0.0 108.019 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.1 -85.93 0.06 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.042 1.306 . . . . 0.0 113.604 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -125.91 0.11 7.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.262 1.825 . . . . 0.0 114.358 -177.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -132.19 171.43 13.67 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.41 1.884 . . . . 0.0 111.023 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 59.5 m -132.79 167.79 19.53 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -172.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.65 125.89 14.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.6 m -74.51 143.77 44.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.487 0.715 . . . . 0.0 111.712 171.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.33 150.15 54.01 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 127.204 2.201 . . . . 0.0 111.19 -172.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -73.88 166.52 29.49 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.475 2.783 . . . . 0.0 113.652 -177.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 C--O 1.245 0.838 0 C-N-CA 124.438 1.095 . . . . 0.0 110.345 167.835 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.3 m . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.78 77.28 7.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.505 1.122 . . . . 0.0 108.046 167.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -43.11 54.32 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.497 1.519 . . . . 0.0 114.491 -167.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.84 -47.08 84.93 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.414 1.006 . . . . 0.0 111.975 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.24 -33.44 76.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.439 1.095 . . . . 0.0 111.434 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.29 -48.27 68.15 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.919 0.888 . . . . 0.0 112.786 170.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -61.53 -43.93 97.97 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.935 -1.103 . . . . 0.0 112.843 177.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.35 -37.69 88.41 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.548 1.067 . . . . 0.0 112.48 176.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 t -63.11 -49.67 73.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.821 0.848 . . . . 0.0 111.885 173.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.3 m -67.44 -42.87 82.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.471 -0.768 . . . . 0.0 111.904 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtp85 -64.07 -20.16 65.74 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.294 -1.504 . . . . 0.0 113.886 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 t -64.72 -31.29 72.44 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.608 0.64 . . . . 0.0 111.881 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -88.98 -16.94 30.51 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.911 1.684 . . . . 0.0 112.727 170.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.4 39.97 5.21 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.828 1.68 . . . . 0.0 115.097 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -147.63 171.62 15.33 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 118.846 1.323 . . . . 0.0 112.046 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.09 165.14 24.99 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.549 1.14 . . . . 0.0 113.251 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -119.97 136.53 11.73 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.242 1.401 . . . . 0.0 112.005 168.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -132.26 143.07 49.65 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.158 1.783 . . . . 0.0 112.024 175.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -81.57 130.62 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.093 0.957 . . . . 0.0 111.586 173.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.3 mt -93.38 -136.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.198 1.399 . . . . 0.0 107.927 171.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.57 81.75 1.09 Allowed Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.68 1.61 . . . . 0.0 112.227 170.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 57.41 31.36 20.08 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.672 1.989 . . . . 0.0 114.245 177.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -152.27 139.93 19.81 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.988 2.115 . . . . 0.0 109.181 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.7 t -96.49 153.62 17.74 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.04 157.12 42.43 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.559 1.144 . . . . 0.0 112.927 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.8 m -88.74 139.91 29.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -147.03 151.36 41.15 Favored Pre-proline 0 N--CA 1.484 1.253 0 C-N-CA 126.969 2.108 . . . . 0.0 112.725 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.22 160.98 47.7 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.781 2.987 . . . . 0.0 114.152 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.78 1.632 . . . . 0.0 112.372 175.194 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.1 p . . . . . 0 CA--C 1.548 0.904 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -53.29 128.25 27.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.308 1.843 . . . . 0.0 113.153 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.62 -41.44 99.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.946 1.298 . . . . 0.0 111.935 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -62.07 -49.63 75.18 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.213 0.915 . . . . 0.0 111.25 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -59.15 -42.07 89.82 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.629 0.65 . . . . 0.0 111.205 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -65.19 -43.18 92.46 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -57.62 -52.7 64.37 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.304 -0.873 . . . . 0.0 111.431 174.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.78 -37.88 85.98 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 118.985 0.811 . . . . 0.0 112.001 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.06 -42.26 99.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.157 0.983 . . . . 0.0 112.301 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.7 m -75.69 -33.39 60.36 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 121.328 -0.858 . . . . 0.0 112.99 175.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -66.5 -16.93 64.51 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 120.252 -1.53 . . . . 0.0 113.408 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.7 t -66.21 -22.92 66.36 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.733 1.213 . . . . 0.0 112.437 167.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -98.66 -26.19 14.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.277 2.231 . . . . 0.0 112.031 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 129.2 -2.41 6.24 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.56 2.028 . . . . 0.0 116.787 169.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -134.64 174.18 10.84 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.721 1.761 . . . . 0.0 113.742 -169.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.2 175.22 7.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.074 0.95 . . . . 0.0 112.382 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -155.17 152.79 24.27 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.506 -0.746 . . . . 0.0 114.271 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -127.21 157.75 38.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.399 2.279 . . . . 0.0 110.152 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -82.64 144.09 30.53 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.538 0.608 . . . . 0.0 112.534 172.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -131.82 115.75 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 126.375 1.87 . . . . 0.0 108.746 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.0 -86.28 0.3 Allowed Glycine 0 CA--C 1.534 1.253 0 C-N-CA 124.4 1.0 . . . . 0.0 111.708 -172.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -141.29 14.95 2.22 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.577 1.951 . . . . 0.0 112.772 169.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -125.96 140.19 52.82 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.878 -1.139 . . . . 0.0 112.276 -169.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.5 t -74.66 142.47 44.51 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.29 -0.882 . . . . 0.0 113.028 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.58 132.13 25.41 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.751 1.62 . . . . 0.0 111.163 173.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.9 m -88.45 148.54 24.14 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.762 1.225 . . . . 0.0 113.898 -169.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.4 m -142.94 146.9 39.29 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.373 1.869 . . . . 0.0 112.172 -170.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -66.8 153.25 78.58 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.046 2.498 . . . . 0.0 113.652 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 . . . . . 0 C--O 1.254 1.299 0 CA-C-O 117.933 -1.032 . . . . 0.0 111.225 169.92 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.5 t . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -100.96 123.7 45.55 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 166.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.56 -41.4 98.42 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -57.91 -49.04 78.1 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.022 0.929 . . . . 0.0 111.999 172.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -64.04 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.789 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -65.81 -45.12 83.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.647 1.179 . . . . 0.0 112.58 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.31 -48.93 75.69 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.928 -1.107 . . . . 0.0 111.666 173.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.0 mt -59.65 -42.49 92.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.558 0.743 . . . . 0.0 111.871 175.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.9 t -60.13 -46.83 88.31 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.16 0.584 . . . . 0.0 111.409 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.1 m -73.97 -25.94 60.2 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -60.91 -31.52 71.03 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.819 -1.176 . . . . 0.0 112.855 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -66.58 -27.85 68.05 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.044 0.937 . . . . 0.0 112.342 172.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.98 -4.11 50.25 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.786 2.034 . . . . 0.0 113.99 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.67 20.81 46.06 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.297 1.427 . . . . 0.0 116.262 173.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -148.9 174.02 12.69 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.154 1.477 . . . . 0.0 113.363 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.5 mt -74.83 168.25 20.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.979 1.312 . . . . 0.0 112.311 -177.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.86 137.07 8.86 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.452 1.025 . . . . 0.0 113.604 176.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -127.36 155.69 43.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 128.075 2.55 . . . . 0.0 111.718 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 70.7 m -94.06 127.23 39.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.792 0.437 . . . . 0.0 110.699 169.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.0 mt -143.66 127.33 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 126.532 1.933 . . . . 0.0 109.236 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.09 22.22 70.5 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 114.304 -174.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.265 27.0 mt-10 62.32 25.3 15.11 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.908 2.083 . . . . 0.0 112.6 -170.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -126.93 160.04 32.23 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.088 2.955 . . . . 0.0 110.386 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.9 t -84.24 139.43 32.37 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 112.468 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.89 130.18 31.31 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.094 1.358 . . . . 0.0 111.026 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -82.19 142.69 31.97 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.563 0.745 . . . . 0.0 110.917 175.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.6 m -139.88 146.49 47.2 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.309 1.044 . . . . 0.0 112.672 -170.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 150.9 54.46 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.329 2.686 . . . . 0.0 112.93 176.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.213 1.405 . . . . 0.0 111.036 169.214 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -91.55 120.97 32.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.458 0.703 . . . . 0.0 109.96 170.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 66.1 tp -67.41 -41.81 84.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.591 0.756 . . . . 0.0 112.627 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.262 0.1 OUTLIER -65.56 -38.75 90.49 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.943 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -69.57 -33.19 72.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.48 1.036 . . . . 0.0 112.628 170.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.41 -41.68 98.73 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.595 1.089 . . . . 0.0 110.789 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.36 -43.02 99.57 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.062 -1.024 . . . . 0.0 113.118 171.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.84 -37.62 87.56 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 120.462 1.483 . . . . 0.0 112.882 172.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.4 m -63.16 -48.44 78.4 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.497 1.119 . . . . 0.0 110.472 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -80.35 -26.48 38.65 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.885 1.274 . . . . 0.0 114.346 -177.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -61.86 -33.74 74.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.385 1.448 . . . . 0.0 112.485 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -66.19 -11.17 47.99 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.26 1.424 . . . . 0.0 113.815 171.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.96 -1.16 20.88 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.143 2.177 . . . . 0.0 112.288 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.96 0.21 62.13 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.838 2.161 . . . . 0.0 116.609 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.56 178.84 7.04 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.486 1.643 . . . . 0.0 114.42 -169.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 mt -78.86 161.8 26.5 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.203 -0.936 . . . . 0.0 112.778 -176.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.68 139.77 15.88 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.999 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -133.16 146.91 51.98 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.039 2.136 . . . . 0.0 109.659 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 97.4 m -84.3 134.26 34.52 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 119.38 0.991 . . . . 0.0 110.096 167.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -128.86 126.28 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.968 1.707 . . . . 0.0 107.967 177.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.34 -103.04 0.6 Allowed Glycine 0 CA--C 1.531 1.092 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -169.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -134.72 21.75 3.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.586 1.554 . . . . 0.0 113.715 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -132.95 157.16 45.85 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.284 1.433 . . . . 0.0 111.711 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -71.59 146.57 48.32 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.066 0.936 . . . . 0.0 112.018 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.17 120.28 17.71 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.656 1.982 . . . . 0.0 109.203 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -81.73 134.57 35.47 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.806 -0.559 . . . . 0.0 110.171 171.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -142.28 151.56 58.61 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 124.999 1.32 . . . . 0.0 112.488 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.8 166.69 13.35 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.34 2.693 . . . . 0.0 114.219 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.142 1.777 . . . . 0.0 112.948 177.164 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -90.54 116.78 28.71 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.869 -0.52 . . . . 0.0 111.504 174.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.4 -36.8 84.93 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.877 -0.514 . . . . 0.0 112.079 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -62.22 -45.02 95.2 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.301 0.5 . . . . 0.0 111.69 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -61.24 -43.43 98.88 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.951 0.796 . . . . 0.0 112.044 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.77 -44.66 89.32 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 176.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.35 -51.12 70.12 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.228 1.011 . . . . 0.0 112.635 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -60.14 -40.58 90.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.26 1.391 . . . . 0.0 112.043 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -54.51 46.32 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.464 1.106 . . . . 0.0 111.745 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.2 m -64.7 -40.1 94.8 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.187 -0.946 . . . . 0.0 112.514 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -70.32 -21.55 62.9 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.994 -1.066 . . . . 0.0 112.895 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -66.85 -27.1 67.26 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.511 1.051 . . . . 0.0 111.4 170.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -83.83 -43.14 15.68 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.667 1.187 . . . . 0.0 111.166 169.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 139.63 10.5 0.79 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 117.047 1.579 . . . . 0.0 117.047 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -129.79 170.91 13.27 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.074 1.937 . . . . 0.0 111.811 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.0 mt -71.8 163.32 28.03 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.06 0.846 . . . . 0.0 112.014 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.68 149.86 18.76 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.682 1.135 . . . . 0.0 113.862 169.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -135.84 134.35 38.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.507 2.323 . . . . 0.0 110.733 171.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 34.6 m -82.52 150.52 26.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -135.86 83.35 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 124.879 1.272 . . . . 0.0 108.157 175.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.81 -80.82 0.09 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 125.644 1.592 . . . . 0.0 113.151 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -125.22 -5.41 7.26 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.629 1.572 . . . . 0.0 113.898 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -97.2 163.01 13.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.544 1.537 . . . . 0.0 111.659 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.6 t -120.09 147.82 44.37 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.196 1.398 . . . . 0.0 111.631 174.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.18 146.95 31.96 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.768 1.627 . . . . 0.0 111.025 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -105.39 137.51 43.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.322 1.049 . . . . 0.0 111.893 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.47 153.58 76.27 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.953 1.301 . . . . 0.0 113.191 -169.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -72.16 155.43 56.62 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.949 2.433 . . . . 0.0 115.563 -176.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.105 1.762 . . . . 0.0 111.033 168.131 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.546 0.795 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -89.16 69.11 8.28 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.146 0.978 . . . . 0.0 111.039 169.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.43 -46.22 76.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.864 0.866 . . . . 0.0 112.692 -172.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -63.66 -44.03 95.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.324 0.966 . . . . 0.0 112.236 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -59.94 -42.47 94.1 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 119.228 0.922 . . . . 0.0 111.962 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.3 t -62.84 -47.75 82.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.082 1.353 . . . . 0.0 112.304 177.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.75 -53.82 53.33 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.777 0.831 . . . . 0.0 111.824 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -58.99 -36.77 75.46 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 121.283 -0.885 . . . . 0.0 112.252 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.4 t -65.24 -50.74 64.67 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.781 1.233 . . . . 0.0 112.425 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.3 m -68.35 -37.91 80.95 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.104 0.962 . . . . 0.0 112.242 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -65.67 -22.75 66.66 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.838 -1.164 . . . . 0.0 113.659 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.7 t -65.3 -37.0 85.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.713 0.805 . . . . 0.0 111.318 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -75.56 -43.07 50.43 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.904 1.282 . . . . 0.0 111.218 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 141.33 9.27 0.67 Allowed Glycine 0 CA--C 1.539 1.533 0 N-CA-C 116.659 1.423 . . . . 0.0 116.659 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -141.55 171.58 13.86 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.448 1.624 . . . . 0.0 112.228 -174.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -77.05 167.13 22.33 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.62 0.768 . . . . 0.0 112.836 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.47 132.82 10.17 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.322 1.439 . . . . 0.0 111.164 168.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -137.77 140.0 40.38 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 119.198 1.499 . . . . 0.0 112.711 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.6 t -82.7 139.33 33.72 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.903 1.281 . . . . 0.0 113.804 -172.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.9 mt -128.41 103.28 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 126.635 1.974 . . . . 0.0 107.528 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.55 -98.24 0.74 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.592 1.091 . . . . 0.0 112.813 -175.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -128.2 3.87 5.79 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.083 2.153 . . . . 0.0 112.966 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -117.43 151.42 37.1 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.528 1.531 . . . . 0.0 110.787 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.4 t -126.29 149.38 49.17 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.158 -0.963 . . . . 0.0 112.218 -175.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 152.16 38.67 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.443 1.497 . . . . 0.0 112.434 -171.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.0 m -87.04 134.93 33.45 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.114 0.966 . . . . 0.0 113.575 -172.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 m -145.85 150.45 42.82 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.738 1.615 . . . . 0.0 113.834 -170.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.95 159.11 48.74 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.022 3.148 . . . . 0.0 114.85 -175.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.233 1.813 . . . . 0.0 111.672 169.282 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.7 t . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -67.2 89.97 0.2 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.08 1.352 . . . . 0.0 111.353 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -71.59 -38.76 70.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.602 1.561 . . . . 0.0 112.33 -173.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.87 -45.39 78.25 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.192 -0.942 . . . . 0.0 112.629 -178.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -59.8 -36.32 76.5 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-N 119.046 0.839 . . . . 0.0 111.621 177.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.2 t -67.57 -46.17 73.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.668 1.587 . . . . 0.0 113.28 174.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -57.66 -47.81 81.25 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.146 1.339 . . . . 0.0 112.393 175.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 45.5 mt -59.92 -41.0 90.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.282 1.033 . . . . 0.0 111.532 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.6 t -64.52 -48.1 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.688 1.195 . . . . 0.0 112.893 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.5 m -68.98 -27.51 65.78 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.082 -1.012 . . . . 0.0 112.327 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -59.19 -34.77 72.53 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.089 -1.007 . . . . 0.0 112.137 175.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 m -67.63 -18.93 65.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.411 1.084 . . . . 0.0 113.639 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.2 mt -98.54 -3.9 35.4 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.852 2.061 . . . . 0.0 112.639 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.87 57.59 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.72 1.628 . . . . 0.0 115.892 175.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -144.54 176.13 9.62 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.581 1.691 . . . . 0.0 113.578 -178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.21 172.33 13.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.858 1.263 . . . . 0.0 112.634 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.46 122.45 2.64 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.674 1.131 . . . . 0.0 111.446 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -119.61 148.01 43.85 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.369 1.467 . . . . 0.0 112.307 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.9 t -78.72 127.42 32.05 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.061 0.545 . . . . 0.0 112.454 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -132.18 100.99 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.99 1.316 . . . . 0.0 109.057 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.27 -124.26 15.96 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 121.495 -0.753 . . . . 0.0 111.607 -172.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -88.94 -2.75 58.74 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -137.54 133.45 34.53 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.661 1.184 . . . . 0.0 113.291 -171.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.7 t -88.36 139.63 30.29 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.434 1.094 . . . . 0.0 111.729 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.31 154.46 50.07 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.941 1.296 . . . . 0.0 111.809 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.9 m -78.88 136.62 37.35 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.4 m -148.75 154.29 40.3 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.69 1.596 . . . . 0.0 113.393 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.12 164.05 36.31 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.124 3.216 . . . . 0.0 114.089 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 126.516 1.927 . . . . 0.0 112.992 -177.902 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -108.94 81.83 1.51 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.844 1.658 . . . . 0.0 109.291 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.2 tp -64.98 -40.21 94.62 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.367 1.067 . . . . 0.0 112.41 -170.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -63.06 -46.33 87.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.202 175.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -61.4 -36.64 80.87 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 119.807 1.185 . . . . 0.0 112.312 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.5 -42.44 95.84 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.735 0.814 . . . . 0.0 112.633 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.33 -48.0 83.62 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.066 -1.021 . . . . 0.0 112.22 173.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 mt -62.55 -34.34 76.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.199 1.0 . . . . 0.0 112.327 177.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 t -66.93 -54.75 18.93 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.419 1.488 . . . . 0.0 112.316 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.3 m -71.67 -26.0 62.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.564 0.746 . . . . 0.0 112.944 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -54.45 -38.42 66.32 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.188 1.395 . . . . 0.0 112.411 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.7 m -74.81 -13.57 60.59 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 178.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.8 mt -92.42 -20.5 20.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.172 1.389 . . . . 0.0 111.988 169.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.28 24.23 10.5 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.154 1.359 . . . . 0.0 115.287 178.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -146.15 173.48 12.17 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 118.795 1.297 . . . . 0.0 112.913 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 mt -76.29 162.77 27.64 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.26 1.024 . . . . 0.0 112.361 -177.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -127.72 128.07 5.98 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.517 1.056 . . . . 0.0 112.815 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -123.64 159.18 29.86 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.214 2.206 . . . . 0.0 111.834 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.7 m -92.41 127.48 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.707 0.803 . . . . 0.0 110.368 168.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -132.82 112.94 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.48 36.29 90.9 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 121.532 -0.73 . . . . 0.0 112.03 -169.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.25 6.6 mp0 61.0 10.52 2.87 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -178.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -111.35 138.26 48.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.291 1.437 . . . . 0.0 110.36 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.9 t -63.39 130.37 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.809 1.244 . . . . 0.0 112.986 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.72 130.67 47.45 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.169 1.787 . . . . 0.0 110.365 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -87.95 136.48 32.95 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.945 -0.472 . . . . 0.0 111.455 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.94 145.85 52.4 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.183 1.393 . . . . 0.0 112.001 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.49 149.39 91.13 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.934 2.423 . . . . 0.0 113.422 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.325 1.05 . . . . 0.0 111.154 169.589 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 t . . . . . 0 CA--C 1.542 0.641 0 CA-C-O 120.722 0.296 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -76.59 127.24 32.43 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.156 0.982 . . . . 0.0 110.332 172.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.31 -45.61 83.65 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.077 -176.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.1 tpp85 -63.88 -42.23 97.53 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.608 1.095 . . . . 0.0 112.736 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 25.3 ttp85 -54.77 -39.83 68.78 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.104 0.865 . . . . 0.0 111.738 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -70.5 -47.02 62.52 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.929 0.892 . . . . 0.0 112.862 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -56.86 -42.93 80.61 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.68 1.192 . . . . 0.0 112.996 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.6 mt -66.24 -33.87 76.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.749 0.704 . . . . 0.0 112.143 176.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.5 p -66.14 -31.91 73.05 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -87.38 -25.08 24.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.278 1.031 . . . . 0.0 113.335 177.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -56.45 -34.14 66.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.367 1.067 . . . . 0.0 110.973 169.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 m -60.02 -20.53 58.33 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.466 1.506 . . . . 0.0 113.404 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.1 mt -107.31 -13.21 15.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.703 1.601 . . . . 0.0 113.775 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.23 14.83 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.264 1.411 . . . . 0.0 116.237 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.91 -177.22 5.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.097 1.449 . . . . 0.0 112.842 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 mt -74.53 162.56 28.68 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.053 0.941 . . . . 0.0 112.195 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.74 147.92 18.69 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 124.432 1.015 . . . . 0.0 111.959 169.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -147.19 139.35 24.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.407 1.883 . . . . 0.0 111.221 -177.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.98 116.18 27.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.13 0.572 . . . . 0.0 110.435 176.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.7 mt -102.54 109.55 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.487 1.115 . . . . 0.0 108.407 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 -84.2 0.18 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.204 0.906 . . . . 0.0 112.625 -178.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.52 21.97 2.18 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.316 1.446 . . . . 0.0 114.108 171.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -140.56 139.75 35.04 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.908 -1.12 . . . . 0.0 112.979 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.61 139.53 51.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.091 1.356 . . . . 0.0 113.662 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.11 48.39 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.473 1.909 . . . . 0.0 110.332 169.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -102.37 103.08 13.48 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.273 0.629 . . . . 0.0 111.141 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 m -90.21 147.52 37.13 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 123.74 0.816 . . . . 0.0 112.153 -176.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -68.57 163.96 34.83 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.838 2.358 . . . . 0.0 112.982 170.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 C--O 1.254 1.334 0 CA-C-O 117.305 -1.331 . . . . 0.0 113.19 173.855 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.544 0.719 0 CA-C-O 120.565 0.222 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -87.27 113.64 23.18 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.65 0.78 . . . . 0.0 109.848 170.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.04 -41.35 78.5 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.408 1.083 . . . . 0.0 112.641 -176.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.4 mmp_? -58.68 -51.49 69.71 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.169 0.895 . . . . 0.0 112.053 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpm_? -61.48 -38.4 87.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.248 0.619 . . . . 0.0 111.415 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.5 t -63.82 -46.55 84.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.259 1.024 . . . . 0.0 113.084 173.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -57.47 -45.44 84.8 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.566 1.076 . . . . 0.0 112.503 175.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.0 mt -70.58 -33.33 70.98 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.939 0.895 . . . . 0.0 111.922 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 t -65.98 -46.01 79.59 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.581 0.352 . . . . 0.0 111.604 171.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.23 -26.46 68.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.735 -1.228 . . . . 0.0 112.955 175.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -60.33 -30.24 69.39 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.822 -1.174 . . . . 0.0 112.224 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.2 m -68.35 -15.28 63.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 171.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.6 mt -105.15 -10.02 17.39 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.964 1.706 . . . . 0.0 112.893 174.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.71 7.2 39.59 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.726 2.108 . . . . 0.0 116.59 174.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.11 179.71 7.04 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.218 2.009 . . . . 0.0 114.347 -170.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.46 168.54 18.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.943 1.297 . . . . 0.0 112.497 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.57 148.79 19.64 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 124.629 1.109 . . . . 0.0 113.567 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -133.11 151.15 52.02 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.869 2.467 . . . . 0.0 110.772 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 93.2 m -99.31 141.77 31.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.108 0.956 . . . . 0.0 113.395 175.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.9 mt -126.31 172.01 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 C-N-CA 129.64 3.176 . . . . 0.0 106.96 173.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.33 102.81 0.09 OUTLIER Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.409 -1.432 . . . . 0.0 113.842 178.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 51.69 35.4 14.95 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 114.444 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -148.36 134.45 19.26 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.554 1.141 . . . . 0.0 112.299 -177.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.5 t -96.32 134.83 38.97 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.283 1.433 . . . . 0.0 110.408 169.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.33 131.48 43.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.009 1.324 . . . . 0.0 111.898 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -91.44 142.55 27.55 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.909 0.884 . . . . 0.0 111.956 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.25 151.0 57.25 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 125.656 1.582 . . . . 0.0 112.334 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.66 160.8 47.15 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.143 2.562 . . . . 0.0 112.984 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.176 1.39 . . . . 0.0 112.649 175.89 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -83.89 161.65 20.79 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.121 0.969 . . . . 0.0 113.385 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.6 m -62.93 118.7 8.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.868 1.667 . . . . 0.0 113.368 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.01 68.67 8.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.536 -0.728 . . . . 0.0 110.1 166.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.9 tp -50.54 -32.21 17.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.63 1.572 . . . . 0.0 113.379 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -59.01 -54.26 49.15 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.931 0.892 . . . . 0.0 112.191 171.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -67.61 -28.68 67.95 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.152 0.887 . . . . 0.0 112.471 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.6 m -66.31 -46.47 76.8 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 124.691 1.197 . . . . 0.0 112.163 170.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.97 -43.1 86.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.36 -0.829 . . . . 0.0 112.346 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.65 -50.52 72.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.118 0.872 . . . . 0.0 111.828 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.7 m -62.73 -41.31 99.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.495 0.718 . . . . 0.0 112.212 -176.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.0 m -77.8 -21.66 51.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 176.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -59.68 -36.04 75.68 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 120.074 1.307 . . . . 0.0 111.842 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -61.9 -24.85 67.2 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.1 mt -93.93 -4.47 49.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.814 1.646 . . . . 0.0 112.765 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.35 14.32 60.36 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.086 1.803 . . . . 0.0 116.333 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.23 178.8 8.65 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 119.872 1.836 . . . . 0.0 114.595 -172.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.9 mt -72.09 168.91 17.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.524 1.53 . . . . 0.0 112.144 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.84 59.97 0.64 Allowed Glycine 0 N--CA 1.474 1.197 0 C-N-CA 126.306 1.908 . . . . 0.0 113.868 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -66.06 148.67 51.46 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.57 1.948 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.4 t -86.35 120.09 27.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.727 0.811 . . . . 0.0 111.709 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -131.8 112.71 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.079 1.352 . . . . 0.0 109.509 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.45 39.54 97.83 Favored Glycine 0 CA--C 1.535 1.288 0 O-C-N 121.426 -0.796 . . . . 0.0 112.659 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.61 22.13 12.57 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.052 1.741 . . . . 0.0 115.352 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -139.33 149.15 43.87 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.123 1.769 . . . . 0.0 110.296 167.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.4 m -79.45 156.97 27.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -150.72 138.43 19.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.921 1.689 . . . . 0.0 110.599 171.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.8 m -82.6 129.99 35.04 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 111.745 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.4 m -148.97 155.79 40.53 Favored Pre-proline 0 N--CA 1.484 1.244 0 C-N-CA 125.859 1.664 . . . . 0.0 113.472 -173.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -67.43 163.2 35.64 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.888 3.059 . . . . 0.0 115.231 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 127.243 2.217 . . . . 0.0 114.321 177.08 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.603 0.24 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -60.9 156.38 17.58 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -168.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 p -59.0 167.43 1.64 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 126.82 2.048 . . . . 0.0 116.249 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -92.68 87.51 5.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.743 1.617 . . . . 0.0 108.896 168.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.8 tp -67.42 -38.68 84.97 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.755 0.822 . . . . 0.0 112.804 -170.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -65.23 -42.74 93.09 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.655 1.116 . . . . 0.0 112.333 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -55.3 -41.92 72.99 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.369 0.986 . . . . 0.0 111.845 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -64.57 -50.07 68.7 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.372 0.669 . . . . 0.0 111.531 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.02 -42.05 93.48 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.745 -1.222 . . . . 0.0 113.725 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.83 -48.97 72.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.639 1.109 . . . . 0.0 111.775 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 79.1 p -67.35 -32.57 73.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.07 -29.13 62.73 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.491 1.041 . . . . 0.0 113.359 170.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.87 -38.74 89.44 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.848 -1.158 . . . . 0.0 111.424 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -56.05 -33.2 64.77 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.659 0.783 . . . . 0.0 112.266 173.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.5 mt -84.71 -13.34 51.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.166 1.387 . . . . 0.0 112.751 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.83 23.18 13.99 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.577 -1.124 . . . . 0.0 115.829 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -155.31 176.12 12.99 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.01 1.405 . . . . 0.0 113.433 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.82 169.74 17.76 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.301 1.441 . . . . 0.0 113.436 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.89 134.52 9.93 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 110.618 167.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -125.04 136.99 54.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.756 1.622 . . . . 0.0 113.384 172.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.53 127.36 32.44 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.896 1.678 . . . . 0.0 110.376 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -87.71 -31.34 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.119 1.368 . . . . 0.0 111.831 176.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.93 -102.54 0.19 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 128.114 2.768 . . . . 0.0 110.988 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -74.83 -21.98 58.96 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.801 -0.823 . . . . 0.0 112.698 171.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.59 167.52 11.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.6 1.96 . . . . 0.0 110.918 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 152.49 47.81 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.257 1.423 . . . . 0.0 111.284 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.29 154.99 43.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.3 m -79.48 137.59 37.27 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -149.59 156.29 38.97 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 126.078 1.751 . . . . 0.0 112.302 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -62.69 168.65 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.93 3.087 . . . . 0.0 115.23 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.249 1.054 0 C-N-CA 126.664 1.986 . . . . 0.0 112.342 174.049 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.638 0.256 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -94.04 144.35 25.55 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.844 0.857 . . . . 0.0 111.518 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.2 t -77.99 120.57 23.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.144 0.578 . . . . 0.0 112.532 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -74.85 69.8 1.88 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.536 1.135 . . . . 0.0 112.341 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.13 -45.23 75.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.709 1.603 . . . . 0.0 112.568 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -61.21 -47.23 87.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.387 0.675 . . . . 0.0 112.129 178.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 -58.79 -40.71 84.81 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.375 0.67 . . . . 0.0 111.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.06 -50.29 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.61 1.164 . . . . 0.0 112.691 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -59.81 -38.14 81.14 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.633 -1.292 . . . . 0.0 113.2 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.36 -34.59 78.5 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.032 0.833 . . . . 0.0 112.395 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.1 t -65.55 -45.55 82.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.459 0.304 . . . . 0.0 111.7 170.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.4 m -70.19 -28.38 65.26 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mtp180 -58.62 -32.49 69.07 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.663 1.185 . . . . 0.0 113.161 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -78.3 0.51 25.12 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 175.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.4 mt -123.83 -3.19 8.21 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 127.147 2.179 . . . . 0.0 113.577 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 13.67 58.92 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.62 1.581 . . . . 0.0 116.969 173.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -145.72 -179.58 6.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.826 1.813 . . . . 0.0 114.54 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 69.0 mt -83.08 169.87 15.42 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.385 1.474 . . . . 0.0 112.825 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.89 129.41 6.56 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.01 1.291 . . . . 0.0 112.038 169.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -124.04 141.81 51.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.962 1.305 . . . . 0.0 113.5 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 99.4 m -81.73 146.06 30.17 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.448 1.499 . . . . 0.0 112.505 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -103.74 -26.61 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-O 123.466 1.603 . . . . 0.0 112.804 -177.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.34 -48.92 0.21 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 128.08 2.752 . . . . 0.0 111.832 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -139.18 -18.55 1.0 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 169.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -101.53 166.94 10.45 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.589 1.555 . . . . 0.0 110.614 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.5 t -136.17 160.31 39.05 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.986 1.314 . . . . 0.0 112.673 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.29 150.28 35.45 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.341 1.456 . . . . 0.0 112.181 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.7 m -81.03 136.31 35.96 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -149.72 154.05 37.16 Favored Pre-proline 0 N--CA 1.481 1.086 0 C-N-CA 126.108 1.763 . . . . 0.0 113.256 -169.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.93 164.1 36.5 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.284 3.323 . . . . 0.0 113.949 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 C--O 1.258 1.502 0 C-N-CA 126.232 1.813 . . . . 0.0 113.946 -177.053 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 119.598 -0.239 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -138.47 140.34 39.18 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.272 1.829 . . . . 0.0 110.603 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.3 m -88.77 109.7 20.39 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.487 1.039 . . . . 0.0 113.497 -179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.36 73.17 7.25 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 166.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.7 tp -57.95 -38.63 76.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -167.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -58.98 -52.48 65.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.259 0.936 . . . . 0.0 110.996 172.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -57.1 -42.54 80.96 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 118.913 0.779 . . . . 0.0 112.79 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 89.4 m -63.62 -38.7 92.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.258 1.023 . . . . 0.0 112.691 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -62.43 -46.99 86.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.121 -0.987 . . . . 0.0 112.564 171.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 77.0 mt -58.5 -44.25 89.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.111 0.869 . . . . 0.0 111.06 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.9 m -57.22 -54.52 45.85 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.123 0.969 . . . . 0.0 112.234 174.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.3 m -63.16 -37.61 87.9 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.46 1.027 . . . . 0.0 112.794 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -63.81 -23.8 67.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.599 -1.313 . . . . 0.0 113.745 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 p -66.95 -28.0 67.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 169.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.8 mt -91.13 -5.29 55.28 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.945 2.098 . . . . 0.0 112.757 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.02 55.27 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 126.251 1.881 . . . . 0.0 116.741 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -132.07 177.88 7.22 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.918 1.859 . . . . 0.0 113.971 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.0 mt -78.8 163.69 25.14 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.565 1.146 . . . . 0.0 113.748 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.2 127.07 6.49 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 125.113 1.339 . . . . 0.0 113.076 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -130.87 153.31 49.27 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.141 1.776 . . . . 0.0 111.755 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.2 t -82.48 137.1 34.74 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.897 0.879 . . . . 0.0 111.0 170.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 35.1 mt -130.65 91.95 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.681 1.192 . . . . 0.0 108.714 174.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.97 55.71 25.03 Favored Glycine 0 CA--C 1.529 0.964 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.629 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 64.26 2.79 1.59 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.467 2.307 . . . . 0.0 116.421 -175.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -118.14 118.65 32.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.168 1.387 . . . . 0.0 111.733 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.7 m -62.57 146.11 52.71 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 159.5 43.28 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.305 1.842 . . . . 0.0 111.624 174.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.7 m -100.81 141.11 34.15 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.026 0.93 . . . . 0.0 112.319 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.97 146.53 52.72 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.791 1.236 . . . . 0.0 112.034 -175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -78.84 162.25 26.8 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.897 2.398 . . . . 0.0 112.073 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.257 1.458 0 C-N-CA 126.061 1.744 . . . . 0.0 114.364 178.601 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -70.85 149.92 46.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.837 0.744 . . . . 0.0 112.823 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.0 p -60.12 135.38 57.7 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -169.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -89.58 76.01 7.42 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.114 0.965 . . . . 0.0 110.066 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.62 -40.75 72.55 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.829 1.252 . . . . 0.0 112.834 -172.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -62.83 -46.99 85.33 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.383 0.992 . . . . 0.0 111.93 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -63.2 -38.39 90.97 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.232 -0.917 . . . . 0.0 111.726 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -61.1 -44.31 97.55 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.989 0.915 . . . . 0.0 112.349 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.35 -41.4 93.58 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.212 1.005 . . . . 0.0 112.618 174.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -65.66 -42.41 91.38 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.948 1.249 . . . . 0.0 111.909 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.0 t -60.52 -32.91 71.92 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.865 0.866 . . . . 0.0 112.315 175.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -81.37 -37.55 28.03 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.137 0.975 . . . . 0.0 113.1 171.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.8 tpp180 -64.13 -28.0 69.47 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 119.986 -1.697 . . . . 0.0 111.889 175.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -60.2 -22.08 62.52 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.406 1.482 . . . . 0.0 112.087 169.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -108.63 1.32 21.22 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 127.968 2.507 . . . . 0.0 113.296 174.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.82 14.06 63.66 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.837 1.684 . . . . 0.0 116.888 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -138.2 175.27 9.72 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.681 2.241 . . . . 0.0 114.6 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.1 mt -81.39 168.87 17.89 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.341 1.056 . . . . 0.0 112.015 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -129.29 140.73 11.94 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 124.918 1.247 . . . . 0.0 112.491 173.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -133.27 141.07 47.82 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.951 1.7 . . . . 0.0 111.534 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.9 t -72.37 155.39 40.2 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.677 1.591 . . . . 0.0 113.032 -176.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.9 mt -110.37 -28.0 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 125.975 1.71 . . . . 0.0 112.499 172.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 158.9 -75.19 0.2 Allowed Glycine 0 CA--C 1.53 0.987 0 C-N-CA 127.385 2.421 . . . . 0.0 111.726 174.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -94.18 -28.93 15.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.063 0.945 . . . . 0.0 112.51 169.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -106.33 177.9 4.72 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.158 1.383 . . . . 0.0 111.973 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -144.6 160.87 40.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.675 1.59 . . . . 0.0 111.561 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.39 154.73 35.05 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.975 0.91 . . . . 0.0 113.007 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.59 152.48 39.26 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.799 1.24 . . . . 0.0 113.982 -175.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -144.47 151.7 51.44 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.188 1.795 . . . . 0.0 113.006 -176.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -71.25 162.04 43.78 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.48 2.786 . . . . 0.0 112.8 170.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.486 1.514 . . . . 0.0 113.39 175.357 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -76.34 151.66 36.59 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -168.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.1 t -75.01 124.85 27.72 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.038 1.735 . . . . 0.0 111.094 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -75.37 103.59 5.58 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.942 0.792 . . . . 0.0 110.376 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.72 -40.72 95.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.581 0.753 . . . . 0.0 111.993 -177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -43.15 91.34 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.061 0.846 . . . . 0.0 112.396 -175.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -59.82 -35.39 74.61 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.893 1.224 . . . . 0.0 111.346 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.87 -37.46 58.9 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 125.071 1.348 . . . . 0.0 113.804 176.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -58.65 -48.52 80.75 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.645 1.111 . . . . 0.0 111.268 171.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 49.0 mt -61.97 -41.35 97.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.405 1.002 . . . . 0.0 111.732 176.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 64.2 m -61.7 -39.32 91.08 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.418 0.687 . . . . 0.0 112.723 176.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.3 m -80.75 -38.72 28.18 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.163 0.892 . . . . 0.0 113.025 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.7 mmm-85 -63.54 -22.76 67.07 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.363 -1.461 . . . . 0.0 113.48 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.79 -35.27 76.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.373 0.669 . . . . 0.0 111.376 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.0 mt -86.94 -34.27 19.39 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.835 1.654 . . . . 0.0 112.176 175.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 137.53 -5.53 3.48 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 125.494 1.521 . . . . 0.0 116.236 170.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -126.93 174.39 8.87 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.366 1.583 . . . . 0.0 113.556 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 mt -72.58 162.06 29.97 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.976 0.893 . . . . 0.0 112.764 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.04 131.12 7.38 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.859 1.219 . . . . 0.0 111.253 172.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.3 142.36 50.56 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.994 1.718 . . . . 0.0 112.188 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 56.2 m -83.67 82.44 8.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.22 1.408 . . . . 0.0 111.133 170.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.03 115.46 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 O-C-N 121.447 -0.783 . . . . 0.0 109.398 -175.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.7 50.47 63.17 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 122.114 -0.367 . . . . 0.0 112.494 -176.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 55.75 26.95 10.06 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.06 144.1 27.66 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.733 -1.229 . . . . 0.0 112.301 170.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.6 m -77.17 137.82 39.1 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -170.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.46 137.75 44.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.61 1.564 . . . . 0.0 110.465 169.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -81.59 137.24 35.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.974 -0.454 . . . . 0.0 110.709 171.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -142.02 148.26 47.92 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 125.19 1.396 . . . . 0.0 111.854 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.3 164.66 33.24 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.12 2.547 . . . . 0.0 112.362 174.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.573 1.549 . . . . 0.0 112.776 -179.224 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -67.39 154.18 41.95 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 -167.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.0 m -56.98 146.89 25.5 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.333 1.453 . . . . 0.0 113.426 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -89.74 72.54 7.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.19 1.396 . . . . 0.0 109.944 169.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.29 -33.36 70.98 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -168.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -62.82 -51.65 66.23 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.504 1.047 . . . . 0.0 111.561 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -57.39 -41.74 80.83 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.162 0.892 . . . . 0.0 110.984 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.93 -46.37 81.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 124.87 1.268 . . . . 0.0 113.715 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.91 -49.69 75.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.099 0.863 . . . . 0.0 112.243 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.91 -38.09 89.82 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.159 0.891 . . . . 0.0 111.754 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -59.74 -52.75 64.17 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.492 0.717 . . . . 0.0 111.645 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.8 m -63.34 -35.35 80.09 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.189 0.904 . . . . 0.0 111.863 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -65.03 -26.15 68.14 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.385 -1.447 . . . . 0.0 113.053 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.6 p -63.96 -18.97 64.79 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.208 0.913 . . . . 0.0 112.848 169.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -107.35 -5.81 17.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.649 2.38 . . . . 0.0 113.599 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.93 16.38 30.87 Favored Glycine 0 CA--C 1.541 1.677 0 N-CA-C 117.235 1.654 . . . . 0.0 117.235 173.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -144.65 169.85 17.21 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.577 1.688 . . . . 0.0 112.868 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.1 mt -77.21 165.86 23.98 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.998 -1.064 . . . . 0.0 113.167 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.93 140.82 13.94 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.997 1.284 . . . . 0.0 111.492 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -140.47 158.67 43.66 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.579 1.952 . . . . 0.0 112.142 176.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -90.6 132.28 35.83 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.31 1.044 . . . . 0.0 112.86 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.7 mt -121.74 103.21 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.625 1.57 . . . . 0.0 108.321 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.1 48.7 81.28 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 123.896 0.76 . . . . 0.0 113.966 176.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.276 79.5 mt-10 64.44 27.3 13.56 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -175.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -146.49 143.07 28.69 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.372 -1.455 . . . . 0.0 110.792 166.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.3 m -84.66 145.36 28.02 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 -169.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.07 146.98 52.41 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.237 2.215 . . . . 0.0 111.656 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.8 m -92.0 138.53 31.46 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.51 0.724 . . . . 0.0 111.23 175.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 m -147.53 153.39 43.55 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 111.34 -169.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.8 155.71 48.73 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.942 2.428 . . . . 0.0 113.408 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.415 1.486 . . . . 0.0 113.127 169.796 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.208 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -93.66 169.22 10.49 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.345 1.458 . . . . 0.0 113.018 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 p -87.18 174.24 8.74 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.876 2.07 . . . . 0.0 114.365 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -75.59 68.25 2.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.233 1.013 . . . . 0.0 111.209 167.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 tp -49.97 -49.59 49.8 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.452 1.501 . . . . 0.0 112.958 -174.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -61.84 -38.77 89.44 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.195 0.907 . . . . 0.0 112.799 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -65.85 -38.11 87.99 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.793 -0.567 . . . . 0.0 111.895 175.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.5 m -75.43 -30.9 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.737 1.215 . . . . 0.0 113.818 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.71 -43.75 80.9 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.51 1.05 . . . . 0.0 110.916 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.3 mt -64.53 -43.71 93.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.235 1.014 . . . . 0.0 112.014 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 m -60.83 -37.88 83.54 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.78 -25.61 61.23 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.198 -0.939 . . . . 0.0 112.81 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -60.06 -39.19 85.17 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.742 -1.224 . . . . 0.0 110.903 171.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -58.68 -23.26 59.08 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.749 0.82 . . . . 0.0 112.967 173.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.48 -8.4 23.19 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.763 1.625 . . . . 0.0 113.922 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.51 33.78 13.02 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.32 1.438 . . . . 0.0 115.205 175.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.37 -178.24 7.12 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.969 1.308 . . . . 0.0 112.621 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.2 mt -85.0 168.23 15.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.596 1.158 . . . . 0.0 112.953 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.71 146.59 17.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.692 1.139 . . . . 0.0 115.056 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -138.32 163.34 32.07 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 128.146 2.578 . . . . 0.0 111.942 173.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.76 154.39 22.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 172.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mt -136.49 91.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 127.915 2.486 . . . . 0.0 105.581 166.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.8 -128.09 31.59 Favored Glycine 0 CA--C 1.536 1.352 0 O-C-N 121.456 -0.778 . . . . 0.0 111.158 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.2 mp0 -84.97 -4.99 59.35 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.974 1.31 . . . . 0.0 114.339 171.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -100.59 177.47 5.0 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.168 1.787 . . . . 0.0 112.524 175.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.3 m -121.82 161.86 21.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.915 1.286 . . . . 0.0 113.479 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.74 154.58 36.57 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.049 1.739 . . . . 0.0 111.031 169.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 54.5 m -95.28 148.69 22.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.418 0.687 . . . . 0.0 112.676 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -141.95 151.96 60.74 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 126.176 1.79 . . . . 0.0 112.411 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.23 158.42 57.73 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.993 2.462 . . . . 0.0 113.868 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.458 1.903 . . . . 0.0 112.906 176.243 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -68.06 140.06 56.27 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.771 0.796 . . . . 0.0 113.067 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.8 t -66.34 132.71 48.96 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.119 1.368 . . . . 0.0 111.069 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -90.81 120.16 31.62 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.778 -1.201 . . . . 0.0 110.984 174.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -74.09 -48.95 26.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.482 0.713 . . . . 0.0 112.696 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.7 ttp180 -62.74 -43.4 98.89 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.198 -0.939 . . . . 0.0 112.354 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -59.27 -37.7 78.28 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.867 0.758 . . . . 0.0 111.099 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -72.43 -36.83 68.68 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.12 1.368 . . . . 0.0 114.395 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -58.56 -47.44 84.24 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.701 1.592 . . . . 0.0 111.733 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -65.55 -36.32 83.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.17 . . . . 0.0 112.5 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -49.18 68.85 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.965 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.5 m -65.84 -23.32 66.65 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.191 -0.943 . . . . 0.0 112.772 175.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -62.33 -31.65 72.3 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.656 -1.277 . . . . 0.0 113.195 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.7 m -67.97 -26.36 65.89 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 169.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.4 mt -85.68 -7.07 59.02 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.244 1.017 . . . . 0.0 112.614 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.29 21.06 39.47 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.842 1.687 . . . . 0.0 115.575 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -149.89 -179.71 7.35 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 119.695 1.748 . . . . 0.0 113.598 -177.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.8 mt -81.37 170.65 15.73 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.161 1.384 . . . . 0.0 112.09 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.49 141.92 12.81 Favored Glycine 0 N--CA 1.472 1.06 0 C-N-CA 124.647 1.117 . . . . 0.0 113.547 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -129.19 151.34 49.96 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 127.007 2.123 . . . . 0.0 111.912 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 m -97.05 135.34 39.18 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.851 1.26 . . . . 0.0 110.672 169.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.6 mt -136.53 110.81 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.788 0.835 . . . . 0.0 109.219 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.84 -127.22 43.84 Favored Glycine 0 CA--C 1.532 1.149 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -83.33 -2.33 55.47 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -152.52 155.83 38.2 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 120.886 1.675 . . . . 0.0 115.355 -170.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -88.08 160.87 17.63 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -142.81 145.17 32.95 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.353 1.861 . . . . 0.0 111.55 168.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.5 m -91.46 143.59 26.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.718 0.807 . . . . 0.0 112.026 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.6 m -141.63 149.5 54.0 Favored Pre-proline 0 N--CA 1.48 1.059 0 C-N-CA 125.266 1.426 . . . . 0.0 112.744 -168.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.24 156.07 65.79 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.417 2.745 . . . . 0.0 113.407 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.256 1.422 . . . . 0.0 111.846 171.487 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.555 0.217 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -56.84 145.35 29.9 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.452 1.101 . . . . 0.0 113.395 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 p -79.51 148.61 31.75 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -99.73 114.3 27.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.295 1.038 . . . . 0.0 110.193 169.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -58.46 -42.64 87.91 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 tpp85 -61.42 -41.57 97.37 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.742 0.701 . . . . 0.0 112.624 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -60.26 -38.7 84.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.235 0.925 . . . . 0.0 111.454 175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.9 m -68.78 -37.8 79.57 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.939 0.896 . . . . 0.0 112.634 174.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -59.15 -45.4 91.07 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.381 1.446 . . . . 0.0 112.911 171.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.4 mt -69.63 -31.02 68.88 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.793 0.837 . . . . 0.0 112.453 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 -39.85 82.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.695 0.798 . . . . 0.0 112.344 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.5 m -71.21 -22.03 62.06 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.348 -0.845 . . . . 0.0 112.459 170.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -64.61 -30.77 71.79 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.508 -1.37 . . . . 0.0 112.225 174.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.7 m -65.69 -9.36 26.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.563 1.145 . . . . 0.0 113.473 168.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.3 mt -119.36 -6.81 10.29 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.184 2.193 . . . . 0.0 112.939 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.52 29.47 24.29 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.058 1.313 . . . . 0.0 116.039 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.87 -179.94 7.9 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.276 1.538 . . . . 0.0 113.55 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.04 176.72 7.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.03 1.732 . . . . 0.0 111.826 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.73 151.01 22.42 Favored Glycine 0 CA--C 1.533 1.164 0 N-CA-C 116.245 1.258 . . . . 0.0 116.245 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -120.83 164.93 15.88 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.478 2.311 . . . . 0.0 112.014 -177.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.1 t -123.24 129.97 52.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.001 1.72 . . . . 0.0 112.377 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -127.26 95.32 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 127.302 2.241 . . . . 0.0 108.019 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.1 -85.93 0.06 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.042 1.306 . . . . 0.0 113.604 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -125.91 0.11 7.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.262 1.825 . . . . 0.0 114.358 -177.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -132.19 171.43 13.67 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.41 1.884 . . . . 0.0 111.023 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 59.5 m -132.79 167.79 19.53 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -172.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.65 125.89 14.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.6 m -74.51 143.77 44.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.487 0.715 . . . . 0.0 111.712 171.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.33 150.15 54.01 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 127.204 2.201 . . . . 0.0 111.19 -172.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -73.88 166.52 29.49 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.475 2.783 . . . . 0.0 113.652 -177.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 C--O 1.245 0.838 0 C-N-CA 124.438 1.095 . . . . 0.0 110.345 167.835 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -47.19 138.23 7.2 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -167.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.3 m -68.18 95.17 0.56 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.494 2.718 . . . . 0.0 113.961 -174.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.78 77.28 7.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.505 1.122 . . . . 0.0 108.046 167.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -43.11 54.32 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.497 1.519 . . . . 0.0 114.491 -167.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.84 -47.08 84.93 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.414 1.006 . . . . 0.0 111.975 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.24 -33.44 76.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.439 1.095 . . . . 0.0 111.434 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.29 -48.27 68.15 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.919 0.888 . . . . 0.0 112.786 170.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -61.53 -43.93 97.97 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.935 -1.103 . . . . 0.0 112.843 177.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.35 -37.69 88.41 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.548 1.067 . . . . 0.0 112.48 176.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 t -63.11 -49.67 73.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.821 0.848 . . . . 0.0 111.885 173.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.3 m -67.44 -42.87 82.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.471 -0.768 . . . . 0.0 111.904 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtp85 -64.07 -20.16 65.74 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.294 -1.504 . . . . 0.0 113.886 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 t -64.72 -31.29 72.44 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.608 0.64 . . . . 0.0 111.881 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -88.98 -16.94 30.51 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.911 1.684 . . . . 0.0 112.727 170.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.4 39.97 5.21 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.828 1.68 . . . . 0.0 115.097 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -147.63 171.62 15.33 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 118.846 1.323 . . . . 0.0 112.046 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.09 165.14 24.99 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.549 1.14 . . . . 0.0 113.251 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -119.97 136.53 11.73 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.242 1.401 . . . . 0.0 112.005 168.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -132.26 143.07 49.65 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.158 1.783 . . . . 0.0 112.024 175.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -81.57 130.62 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.093 0.957 . . . . 0.0 111.586 173.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.3 mt -93.38 -136.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.198 1.399 . . . . 0.0 107.927 171.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.57 81.75 1.09 Allowed Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.68 1.61 . . . . 0.0 112.227 170.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 57.41 31.36 20.08 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.672 1.989 . . . . 0.0 114.245 177.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -152.27 139.93 19.81 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.988 2.115 . . . . 0.0 109.181 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.7 t -96.49 153.62 17.74 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.04 157.12 42.43 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.559 1.144 . . . . 0.0 112.927 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.8 m -88.74 139.91 29.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -147.03 151.36 41.15 Favored Pre-proline 0 N--CA 1.484 1.253 0 C-N-CA 126.969 2.108 . . . . 0.0 112.725 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.22 160.98 47.7 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.781 2.987 . . . . 0.0 114.152 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.78 1.632 . . . . 0.0 112.372 175.194 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.769 0 CA-C-O 120.699 0.285 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -136.33 156.36 48.76 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.933 2.093 . . . . 0.0 107.592 172.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.1 p -71.05 67.84 0.43 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -172.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -53.29 128.25 27.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.308 1.843 . . . . 0.0 113.153 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.62 -41.44 99.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.946 1.298 . . . . 0.0 111.935 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -62.07 -49.63 75.18 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.213 0.915 . . . . 0.0 111.25 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -59.15 -42.07 89.82 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.629 0.65 . . . . 0.0 111.205 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -65.19 -43.18 92.46 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -57.62 -52.7 64.37 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.304 -0.873 . . . . 0.0 111.431 174.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.78 -37.88 85.98 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 118.985 0.811 . . . . 0.0 112.001 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.06 -42.26 99.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.157 0.983 . . . . 0.0 112.301 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.7 m -75.69 -33.39 60.36 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 121.328 -0.858 . . . . 0.0 112.99 175.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -66.5 -16.93 64.51 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 120.252 -1.53 . . . . 0.0 113.408 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.7 t -66.21 -22.92 66.36 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.733 1.213 . . . . 0.0 112.437 167.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -98.66 -26.19 14.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.277 2.231 . . . . 0.0 112.031 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 129.2 -2.41 6.24 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.56 2.028 . . . . 0.0 116.787 169.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -134.64 174.18 10.84 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.721 1.761 . . . . 0.0 113.742 -169.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.2 175.22 7.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.074 0.95 . . . . 0.0 112.382 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -155.17 152.79 24.27 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.506 -0.746 . . . . 0.0 114.271 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -127.21 157.75 38.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.399 2.279 . . . . 0.0 110.152 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -82.64 144.09 30.53 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.538 0.608 . . . . 0.0 112.534 172.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -131.82 115.75 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 126.375 1.87 . . . . 0.0 108.746 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.0 -86.28 0.3 Allowed Glycine 0 CA--C 1.534 1.253 0 C-N-CA 124.4 1.0 . . . . 0.0 111.708 -172.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -141.29 14.95 2.22 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.577 1.951 . . . . 0.0 112.772 169.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -125.96 140.19 52.82 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.878 -1.139 . . . . 0.0 112.276 -169.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.5 t -74.66 142.47 44.51 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.29 -0.882 . . . . 0.0 113.028 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.58 132.13 25.41 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.751 1.62 . . . . 0.0 111.163 173.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.9 m -88.45 148.54 24.14 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.762 1.225 . . . . 0.0 113.898 -169.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.4 m -142.94 146.9 39.29 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.373 1.869 . . . . 0.0 112.172 -170.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -66.8 153.25 78.58 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.046 2.498 . . . . 0.0 113.652 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 . . . . . 0 C--O 1.254 1.299 0 CA-C-O 117.933 -1.032 . . . . 0.0 111.225 169.92 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -88.17 169.06 12.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 113.199 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.5 t -68.87 126.6 30.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 113.819 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -100.96 123.7 45.55 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 166.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.56 -41.4 98.42 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -57.91 -49.04 78.1 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.022 0.929 . . . . 0.0 111.999 172.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -64.04 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.789 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -65.81 -45.12 83.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.647 1.179 . . . . 0.0 112.58 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.31 -48.93 75.69 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.928 -1.107 . . . . 0.0 111.666 173.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.0 mt -59.65 -42.49 92.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.558 0.743 . . . . 0.0 111.871 175.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.9 t -60.13 -46.83 88.31 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.16 0.584 . . . . 0.0 111.409 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.1 m -73.97 -25.94 60.2 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -60.91 -31.52 71.03 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.819 -1.176 . . . . 0.0 112.855 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -66.58 -27.85 68.05 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.044 0.937 . . . . 0.0 112.342 172.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.98 -4.11 50.25 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.786 2.034 . . . . 0.0 113.99 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.67 20.81 46.06 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.297 1.427 . . . . 0.0 116.262 173.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -148.9 174.02 12.69 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.154 1.477 . . . . 0.0 113.363 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.5 mt -74.83 168.25 20.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.979 1.312 . . . . 0.0 112.311 -177.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.86 137.07 8.86 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.452 1.025 . . . . 0.0 113.604 176.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -127.36 155.69 43.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 128.075 2.55 . . . . 0.0 111.718 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 70.7 m -94.06 127.23 39.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.792 0.437 . . . . 0.0 110.699 169.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.0 mt -143.66 127.33 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 126.532 1.933 . . . . 0.0 109.236 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.09 22.22 70.5 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 114.304 -174.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.265 27.0 mt-10 62.32 25.3 15.11 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.908 2.083 . . . . 0.0 112.6 -170.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -126.93 160.04 32.23 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.088 2.955 . . . . 0.0 110.386 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.9 t -84.24 139.43 32.37 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 112.468 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.89 130.18 31.31 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.094 1.358 . . . . 0.0 111.026 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -82.19 142.69 31.97 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.563 0.745 . . . . 0.0 110.917 175.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.6 m -139.88 146.49 47.2 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.309 1.044 . . . . 0.0 112.672 -170.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 150.9 54.46 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.329 2.686 . . . . 0.0 112.93 176.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.213 1.405 . . . . 0.0 111.036 169.214 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -107.41 163.29 13.17 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.332 1.053 . . . . 0.0 109.956 167.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -101.04 126.07 47.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.717 1.207 . . . . 0.0 111.865 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -91.55 120.97 32.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.458 0.703 . . . . 0.0 109.96 170.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 66.1 tp -67.41 -41.81 84.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.591 0.756 . . . . 0.0 112.627 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.262 0.1 OUTLIER -65.56 -38.75 90.49 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.943 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -69.57 -33.19 72.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.48 1.036 . . . . 0.0 112.628 170.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.41 -41.68 98.73 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.595 1.089 . . . . 0.0 110.789 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.36 -43.02 99.57 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.062 -1.024 . . . . 0.0 113.118 171.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.84 -37.62 87.56 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 120.462 1.483 . . . . 0.0 112.882 172.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.4 m -63.16 -48.44 78.4 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.497 1.119 . . . . 0.0 110.472 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -80.35 -26.48 38.65 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.885 1.274 . . . . 0.0 114.346 -177.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -61.86 -33.74 74.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.385 1.448 . . . . 0.0 112.485 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -66.19 -11.17 47.99 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.26 1.424 . . . . 0.0 113.815 171.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.96 -1.16 20.88 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.143 2.177 . . . . 0.0 112.288 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.96 0.21 62.13 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.838 2.161 . . . . 0.0 116.609 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.56 178.84 7.04 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.486 1.643 . . . . 0.0 114.42 -169.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 mt -78.86 161.8 26.5 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.203 -0.936 . . . . 0.0 112.778 -176.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.68 139.77 15.88 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.999 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -133.16 146.91 51.98 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.039 2.136 . . . . 0.0 109.659 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 97.4 m -84.3 134.26 34.52 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 119.38 0.991 . . . . 0.0 110.096 167.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -128.86 126.28 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.968 1.707 . . . . 0.0 107.967 177.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.34 -103.04 0.6 Allowed Glycine 0 CA--C 1.531 1.092 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -169.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -134.72 21.75 3.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.586 1.554 . . . . 0.0 113.715 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -132.95 157.16 45.85 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.284 1.433 . . . . 0.0 111.711 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -71.59 146.57 48.32 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.066 0.936 . . . . 0.0 112.018 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.17 120.28 17.71 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.656 1.982 . . . . 0.0 109.203 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -81.73 134.57 35.47 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.806 -0.559 . . . . 0.0 110.171 171.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -142.28 151.56 58.61 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 124.999 1.32 . . . . 0.0 112.488 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.8 166.69 13.35 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.34 2.693 . . . . 0.0 114.219 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.142 1.777 . . . . 0.0 112.948 177.164 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 110.692 -0.114 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -60.31 149.61 33.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 t -65.01 140.29 58.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.538 1.535 . . . . 0.0 111.801 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -90.54 116.78 28.71 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.869 -0.52 . . . . 0.0 111.504 174.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.4 -36.8 84.93 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.877 -0.514 . . . . 0.0 112.079 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -62.22 -45.02 95.2 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.301 0.5 . . . . 0.0 111.69 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -61.24 -43.43 98.88 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.951 0.796 . . . . 0.0 112.044 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.77 -44.66 89.32 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 176.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.35 -51.12 70.12 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.228 1.011 . . . . 0.0 112.635 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -60.14 -40.58 90.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.26 1.391 . . . . 0.0 112.043 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -54.51 46.32 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.464 1.106 . . . . 0.0 111.745 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.2 m -64.7 -40.1 94.8 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.187 -0.946 . . . . 0.0 112.514 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -70.32 -21.55 62.9 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.994 -1.066 . . . . 0.0 112.895 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -66.85 -27.1 67.26 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.511 1.051 . . . . 0.0 111.4 170.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -83.83 -43.14 15.68 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.667 1.187 . . . . 0.0 111.166 169.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 139.63 10.5 0.79 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 117.047 1.579 . . . . 0.0 117.047 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -129.79 170.91 13.27 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.074 1.937 . . . . 0.0 111.811 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.0 mt -71.8 163.32 28.03 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.06 0.846 . . . . 0.0 112.014 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.68 149.86 18.76 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.682 1.135 . . . . 0.0 113.862 169.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -135.84 134.35 38.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.507 2.323 . . . . 0.0 110.733 171.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 34.6 m -82.52 150.52 26.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -135.86 83.35 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 124.879 1.272 . . . . 0.0 108.157 175.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.81 -80.82 0.09 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 125.644 1.592 . . . . 0.0 113.151 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -125.22 -5.41 7.26 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.629 1.572 . . . . 0.0 113.898 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -97.2 163.01 13.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.544 1.537 . . . . 0.0 111.659 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.6 t -120.09 147.82 44.37 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.196 1.398 . . . . 0.0 111.631 174.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.18 146.95 31.96 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.768 1.627 . . . . 0.0 111.025 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -105.39 137.51 43.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.322 1.049 . . . . 0.0 111.893 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.47 153.58 76.27 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.953 1.301 . . . . 0.0 113.191 -169.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -72.16 155.43 56.62 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.949 2.433 . . . . 0.0 115.563 -176.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.105 1.762 . . . . 0.0 111.033 168.131 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 111.3 0.111 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -129.43 151.5 49.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.696 1.198 . . . . 0.0 113.268 -178.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -67.16 130.54 43.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.176 1.79 . . . . 0.0 112.699 176.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -89.16 69.11 8.28 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.146 0.978 . . . . 0.0 111.039 169.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.43 -46.22 76.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.864 0.866 . . . . 0.0 112.692 -172.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -63.66 -44.03 95.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.324 0.966 . . . . 0.0 112.236 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -59.94 -42.47 94.1 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 119.228 0.922 . . . . 0.0 111.962 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.3 t -62.84 -47.75 82.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.082 1.353 . . . . 0.0 112.304 177.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.75 -53.82 53.33 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.777 0.831 . . . . 0.0 111.824 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -58.99 -36.77 75.46 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 121.283 -0.885 . . . . 0.0 112.252 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.4 t -65.24 -50.74 64.67 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.781 1.233 . . . . 0.0 112.425 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.3 m -68.35 -37.91 80.95 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.104 0.962 . . . . 0.0 112.242 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -65.67 -22.75 66.66 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.838 -1.164 . . . . 0.0 113.659 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.7 t -65.3 -37.0 85.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.713 0.805 . . . . 0.0 111.318 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -75.56 -43.07 50.43 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.904 1.282 . . . . 0.0 111.218 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 141.33 9.27 0.67 Allowed Glycine 0 CA--C 1.539 1.533 0 N-CA-C 116.659 1.423 . . . . 0.0 116.659 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -141.55 171.58 13.86 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.448 1.624 . . . . 0.0 112.228 -174.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -77.05 167.13 22.33 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.62 0.768 . . . . 0.0 112.836 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.47 132.82 10.17 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.322 1.439 . . . . 0.0 111.164 168.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -137.77 140.0 40.38 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 119.198 1.499 . . . . 0.0 112.711 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.6 t -82.7 139.33 33.72 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.903 1.281 . . . . 0.0 113.804 -172.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.9 mt -128.41 103.28 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 126.635 1.974 . . . . 0.0 107.528 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.55 -98.24 0.74 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.592 1.091 . . . . 0.0 112.813 -175.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -128.2 3.87 5.79 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.083 2.153 . . . . 0.0 112.966 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -117.43 151.42 37.1 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.528 1.531 . . . . 0.0 110.787 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.4 t -126.29 149.38 49.17 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.158 -0.963 . . . . 0.0 112.218 -175.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 152.16 38.67 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.443 1.497 . . . . 0.0 112.434 -171.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.0 m -87.04 134.93 33.45 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.114 0.966 . . . . 0.0 113.575 -172.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 m -145.85 150.45 42.82 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.738 1.615 . . . . 0.0 113.834 -170.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.95 159.11 48.74 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.022 3.148 . . . . 0.0 114.85 -175.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.233 1.813 . . . . 0.0 111.672 169.282 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.202 0.075 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -139.97 72.72 1.4 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.533 1.533 . . . . 0.0 110.458 -175.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.7 t 57.71 72.78 0.5 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.684 1.594 . . . . 0.0 113.271 -168.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -67.2 89.97 0.2 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.08 1.352 . . . . 0.0 111.353 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -71.59 -38.76 70.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.602 1.561 . . . . 0.0 112.33 -173.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.87 -45.39 78.25 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.192 -0.942 . . . . 0.0 112.629 -178.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -59.8 -36.32 76.5 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-N 119.046 0.839 . . . . 0.0 111.621 177.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.2 t -67.57 -46.17 73.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.668 1.587 . . . . 0.0 113.28 174.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -57.66 -47.81 81.25 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.146 1.339 . . . . 0.0 112.393 175.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 45.5 mt -59.92 -41.0 90.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.282 1.033 . . . . 0.0 111.532 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.6 t -64.52 -48.1 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.688 1.195 . . . . 0.0 112.893 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.5 m -68.98 -27.51 65.78 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.082 -1.012 . . . . 0.0 112.327 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -59.19 -34.77 72.53 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.089 -1.007 . . . . 0.0 112.137 175.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 m -67.63 -18.93 65.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.411 1.084 . . . . 0.0 113.639 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.2 mt -98.54 -3.9 35.4 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.852 2.061 . . . . 0.0 112.639 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.87 57.59 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.72 1.628 . . . . 0.0 115.892 175.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -144.54 176.13 9.62 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.581 1.691 . . . . 0.0 113.578 -178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.21 172.33 13.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.858 1.263 . . . . 0.0 112.634 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.46 122.45 2.64 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.674 1.131 . . . . 0.0 111.446 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -119.61 148.01 43.85 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.369 1.467 . . . . 0.0 112.307 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.9 t -78.72 127.42 32.05 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.061 0.545 . . . . 0.0 112.454 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -132.18 100.99 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.99 1.316 . . . . 0.0 109.057 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.27 -124.26 15.96 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 121.495 -0.753 . . . . 0.0 111.607 -172.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -88.94 -2.75 58.74 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -137.54 133.45 34.53 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.661 1.184 . . . . 0.0 113.291 -171.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.7 t -88.36 139.63 30.29 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.434 1.094 . . . . 0.0 111.729 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.31 154.46 50.07 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.941 1.296 . . . . 0.0 111.809 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.9 m -78.88 136.62 37.35 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.4 m -148.75 154.29 40.3 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.69 1.596 . . . . 0.0 113.393 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.12 164.05 36.31 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.124 3.216 . . . . 0.0 114.089 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 126.516 1.927 . . . . 0.0 112.992 -177.902 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 119.54 -0.267 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -145.27 139.68 27.28 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.451 1.501 . . . . 0.0 111.72 175.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -76.54 111.27 11.83 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 -172.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -108.94 81.83 1.51 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.844 1.658 . . . . 0.0 109.291 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.2 tp -64.98 -40.21 94.62 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.367 1.067 . . . . 0.0 112.41 -170.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -63.06 -46.33 87.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.202 175.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -61.4 -36.64 80.87 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 119.807 1.185 . . . . 0.0 112.312 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.5 -42.44 95.84 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.735 0.814 . . . . 0.0 112.633 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.33 -48.0 83.62 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.066 -1.021 . . . . 0.0 112.22 173.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 mt -62.55 -34.34 76.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.199 1.0 . . . . 0.0 112.327 177.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 t -66.93 -54.75 18.93 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.419 1.488 . . . . 0.0 112.316 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.3 m -71.67 -26.0 62.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.564 0.746 . . . . 0.0 112.944 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -54.45 -38.42 66.32 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.188 1.395 . . . . 0.0 112.411 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.7 m -74.81 -13.57 60.59 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 178.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.8 mt -92.42 -20.5 20.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.172 1.389 . . . . 0.0 111.988 169.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.28 24.23 10.5 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.154 1.359 . . . . 0.0 115.287 178.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -146.15 173.48 12.17 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 118.795 1.297 . . . . 0.0 112.913 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 mt -76.29 162.77 27.64 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.26 1.024 . . . . 0.0 112.361 -177.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -127.72 128.07 5.98 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.517 1.056 . . . . 0.0 112.815 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -123.64 159.18 29.86 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.214 2.206 . . . . 0.0 111.834 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.7 m -92.41 127.48 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.707 0.803 . . . . 0.0 110.368 168.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -132.82 112.94 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.48 36.29 90.9 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 121.532 -0.73 . . . . 0.0 112.03 -169.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.25 6.6 mp0 61.0 10.52 2.87 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -178.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -111.35 138.26 48.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.291 1.437 . . . . 0.0 110.36 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.9 t -63.39 130.37 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.809 1.244 . . . . 0.0 112.986 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.72 130.67 47.45 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.169 1.787 . . . . 0.0 110.365 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -87.95 136.48 32.95 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.945 -0.472 . . . . 0.0 111.455 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.94 145.85 52.4 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.183 1.393 . . . . 0.0 112.001 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.49 149.39 91.13 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.934 2.423 . . . . 0.0 113.422 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.325 1.05 . . . . 0.0 111.154 169.589 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -114.79 144.32 43.69 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.693 1.197 . . . . 0.0 112.593 169.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 t -74.69 122.71 23.66 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.133 1.373 . . . . 0.0 110.596 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -76.59 127.24 32.43 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.156 0.982 . . . . 0.0 110.332 172.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.31 -45.61 83.65 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.077 -176.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.1 tpp85 -63.88 -42.23 97.53 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.608 1.095 . . . . 0.0 112.736 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 25.3 ttp85 -54.77 -39.83 68.78 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.104 0.865 . . . . 0.0 111.738 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -70.5 -47.02 62.52 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.929 0.892 . . . . 0.0 112.862 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -56.86 -42.93 80.61 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.68 1.192 . . . . 0.0 112.996 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.6 mt -66.24 -33.87 76.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.749 0.704 . . . . 0.0 112.143 176.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.5 p -66.14 -31.91 73.05 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -87.38 -25.08 24.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.278 1.031 . . . . 0.0 113.335 177.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -56.45 -34.14 66.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.367 1.067 . . . . 0.0 110.973 169.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 m -60.02 -20.53 58.33 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.466 1.506 . . . . 0.0 113.404 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.1 mt -107.31 -13.21 15.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.703 1.601 . . . . 0.0 113.775 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.23 14.83 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.264 1.411 . . . . 0.0 116.237 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.91 -177.22 5.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.097 1.449 . . . . 0.0 112.842 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 mt -74.53 162.56 28.68 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.053 0.941 . . . . 0.0 112.195 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.74 147.92 18.69 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 124.432 1.015 . . . . 0.0 111.959 169.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -147.19 139.35 24.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.407 1.883 . . . . 0.0 111.221 -177.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.98 116.18 27.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.13 0.572 . . . . 0.0 110.435 176.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.7 mt -102.54 109.55 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.487 1.115 . . . . 0.0 108.407 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 -84.2 0.18 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.204 0.906 . . . . 0.0 112.625 -178.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.52 21.97 2.18 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.316 1.446 . . . . 0.0 114.108 171.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -140.56 139.75 35.04 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.908 -1.12 . . . . 0.0 112.979 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.61 139.53 51.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.091 1.356 . . . . 0.0 113.662 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.11 48.39 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.473 1.909 . . . . 0.0 110.332 169.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -102.37 103.08 13.48 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.273 0.629 . . . . 0.0 111.141 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 m -90.21 147.52 37.13 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 123.74 0.816 . . . . 0.0 112.153 -176.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -68.57 163.96 34.83 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.838 2.358 . . . . 0.0 112.982 170.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 C--O 1.254 1.334 0 CA-C-O 117.305 -1.331 . . . . 0.0 113.19 173.855 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 120.588 0.232 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.15 145.85 47.82 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 112.002 -171.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -63.41 129.34 39.84 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.44 1.496 . . . . 0.0 111.4 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -87.27 113.64 23.18 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.65 0.78 . . . . 0.0 109.848 170.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.04 -41.35 78.5 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.408 1.083 . . . . 0.0 112.641 -176.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.4 mmp_? -58.68 -51.49 69.71 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.169 0.895 . . . . 0.0 112.053 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpm_? -61.48 -38.4 87.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.248 0.619 . . . . 0.0 111.415 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.5 t -63.82 -46.55 84.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.259 1.024 . . . . 0.0 113.084 173.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -57.47 -45.44 84.8 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.566 1.076 . . . . 0.0 112.503 175.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.0 mt -70.58 -33.33 70.98 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.939 0.895 . . . . 0.0 111.922 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 t -65.98 -46.01 79.59 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.581 0.352 . . . . 0.0 111.604 171.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.23 -26.46 68.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.735 -1.228 . . . . 0.0 112.955 175.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -60.33 -30.24 69.39 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.822 -1.174 . . . . 0.0 112.224 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.2 m -68.35 -15.28 63.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 171.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.6 mt -105.15 -10.02 17.39 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.964 1.706 . . . . 0.0 112.893 174.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.71 7.2 39.59 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.726 2.108 . . . . 0.0 116.59 174.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.11 179.71 7.04 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.218 2.009 . . . . 0.0 114.347 -170.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.46 168.54 18.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.943 1.297 . . . . 0.0 112.497 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.57 148.79 19.64 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 124.629 1.109 . . . . 0.0 113.567 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -133.11 151.15 52.02 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.869 2.467 . . . . 0.0 110.772 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 93.2 m -99.31 141.77 31.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.108 0.956 . . . . 0.0 113.395 175.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.9 mt -126.31 172.01 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 C-N-CA 129.64 3.176 . . . . 0.0 106.96 173.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.33 102.81 0.09 OUTLIER Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.409 -1.432 . . . . 0.0 113.842 178.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 51.69 35.4 14.95 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 114.444 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -148.36 134.45 19.26 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.554 1.141 . . . . 0.0 112.299 -177.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.5 t -96.32 134.83 38.97 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.283 1.433 . . . . 0.0 110.408 169.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.33 131.48 43.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.009 1.324 . . . . 0.0 111.898 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -91.44 142.55 27.55 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.909 0.884 . . . . 0.0 111.956 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.25 151.0 57.25 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 125.656 1.582 . . . . 0.0 112.334 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.66 160.8 47.15 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.143 2.562 . . . . 0.0 112.984 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.176 1.39 . . . . 0.0 112.649 175.89 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.6 m . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.01 68.67 8.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.536 -0.728 . . . . 0.0 110.1 166.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.9 tp -50.54 -32.21 17.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.63 1.572 . . . . 0.0 113.379 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -59.01 -54.26 49.15 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.931 0.892 . . . . 0.0 112.191 171.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -67.61 -28.68 67.95 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.152 0.887 . . . . 0.0 112.471 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.6 m -66.31 -46.47 76.8 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 124.691 1.197 . . . . 0.0 112.163 170.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.97 -43.1 86.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.36 -0.829 . . . . 0.0 112.346 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.65 -50.52 72.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.118 0.872 . . . . 0.0 111.828 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.7 m -62.73 -41.31 99.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.495 0.718 . . . . 0.0 112.212 -176.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.0 m -77.8 -21.66 51.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 176.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -59.68 -36.04 75.68 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 120.074 1.307 . . . . 0.0 111.842 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -61.9 -24.85 67.2 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.1 mt -93.93 -4.47 49.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.814 1.646 . . . . 0.0 112.765 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.35 14.32 60.36 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.086 1.803 . . . . 0.0 116.333 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.23 178.8 8.65 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 119.872 1.836 . . . . 0.0 114.595 -172.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.9 mt -72.09 168.91 17.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.524 1.53 . . . . 0.0 112.144 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.84 59.97 0.64 Allowed Glycine 0 N--CA 1.474 1.197 0 C-N-CA 126.306 1.908 . . . . 0.0 113.868 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -66.06 148.67 51.46 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.57 1.948 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.4 t -86.35 120.09 27.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.727 0.811 . . . . 0.0 111.709 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -131.8 112.71 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.079 1.352 . . . . 0.0 109.509 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.45 39.54 97.83 Favored Glycine 0 CA--C 1.535 1.288 0 O-C-N 121.426 -0.796 . . . . 0.0 112.659 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.61 22.13 12.57 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.052 1.741 . . . . 0.0 115.352 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -139.33 149.15 43.87 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.123 1.769 . . . . 0.0 110.296 167.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.4 m -79.45 156.97 27.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -150.72 138.43 19.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.921 1.689 . . . . 0.0 110.599 171.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.8 m -82.6 129.99 35.04 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 111.745 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.4 m -148.97 155.79 40.53 Favored Pre-proline 0 N--CA 1.484 1.244 0 C-N-CA 125.859 1.664 . . . . 0.0 113.472 -173.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -67.43 163.2 35.64 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.888 3.059 . . . . 0.0 115.231 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 127.243 2.217 . . . . 0.0 114.321 177.08 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 CA--C 1.552 1.048 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -92.68 87.51 5.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.743 1.617 . . . . 0.0 108.896 168.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.8 tp -67.42 -38.68 84.97 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.755 0.822 . . . . 0.0 112.804 -170.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -65.23 -42.74 93.09 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.655 1.116 . . . . 0.0 112.333 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -55.3 -41.92 72.99 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.369 0.986 . . . . 0.0 111.845 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -64.57 -50.07 68.7 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.372 0.669 . . . . 0.0 111.531 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.02 -42.05 93.48 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.745 -1.222 . . . . 0.0 113.725 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.83 -48.97 72.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.639 1.109 . . . . 0.0 111.775 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 79.1 p -67.35 -32.57 73.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.07 -29.13 62.73 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.491 1.041 . . . . 0.0 113.359 170.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.87 -38.74 89.44 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.848 -1.158 . . . . 0.0 111.424 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -56.05 -33.2 64.77 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.659 0.783 . . . . 0.0 112.266 173.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.5 mt -84.71 -13.34 51.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.166 1.387 . . . . 0.0 112.751 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.83 23.18 13.99 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.577 -1.124 . . . . 0.0 115.829 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -155.31 176.12 12.99 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.01 1.405 . . . . 0.0 113.433 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.82 169.74 17.76 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.301 1.441 . . . . 0.0 113.436 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.89 134.52 9.93 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 110.618 167.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -125.04 136.99 54.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.756 1.622 . . . . 0.0 113.384 172.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.53 127.36 32.44 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.896 1.678 . . . . 0.0 110.376 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -87.71 -31.34 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.119 1.368 . . . . 0.0 111.831 176.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.93 -102.54 0.19 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 128.114 2.768 . . . . 0.0 110.988 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -74.83 -21.98 58.96 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.801 -0.823 . . . . 0.0 112.698 171.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.59 167.52 11.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.6 1.96 . . . . 0.0 110.918 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 152.49 47.81 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.257 1.423 . . . . 0.0 111.284 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.29 154.99 43.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.3 m -79.48 137.59 37.27 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -149.59 156.29 38.97 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 126.078 1.751 . . . . 0.0 112.302 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -62.69 168.65 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.93 3.087 . . . . 0.0 115.23 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.249 1.054 0 C-N-CA 126.664 1.986 . . . . 0.0 112.342 174.049 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.2 t . . . . . 0 CA--C 1.541 0.628 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -74.85 69.8 1.88 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.536 1.135 . . . . 0.0 112.341 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.13 -45.23 75.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.709 1.603 . . . . 0.0 112.568 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -61.21 -47.23 87.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.387 0.675 . . . . 0.0 112.129 178.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 -58.79 -40.71 84.81 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.375 0.67 . . . . 0.0 111.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.06 -50.29 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.61 1.164 . . . . 0.0 112.691 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -59.81 -38.14 81.14 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.633 -1.292 . . . . 0.0 113.2 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.36 -34.59 78.5 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.032 0.833 . . . . 0.0 112.395 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.1 t -65.55 -45.55 82.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.459 0.304 . . . . 0.0 111.7 170.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.4 m -70.19 -28.38 65.26 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mtp180 -58.62 -32.49 69.07 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.663 1.185 . . . . 0.0 113.161 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -78.3 0.51 25.12 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 175.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.4 mt -123.83 -3.19 8.21 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 127.147 2.179 . . . . 0.0 113.577 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 13.67 58.92 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.62 1.581 . . . . 0.0 116.969 173.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -145.72 -179.58 6.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.826 1.813 . . . . 0.0 114.54 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 69.0 mt -83.08 169.87 15.42 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.385 1.474 . . . . 0.0 112.825 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.89 129.41 6.56 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.01 1.291 . . . . 0.0 112.038 169.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -124.04 141.81 51.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.962 1.305 . . . . 0.0 113.5 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 99.4 m -81.73 146.06 30.17 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.448 1.499 . . . . 0.0 112.505 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -103.74 -26.61 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-O 123.466 1.603 . . . . 0.0 112.804 -177.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.34 -48.92 0.21 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 128.08 2.752 . . . . 0.0 111.832 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -139.18 -18.55 1.0 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 169.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -101.53 166.94 10.45 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.589 1.555 . . . . 0.0 110.614 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.5 t -136.17 160.31 39.05 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.986 1.314 . . . . 0.0 112.673 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.29 150.28 35.45 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.341 1.456 . . . . 0.0 112.181 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.7 m -81.03 136.31 35.96 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -149.72 154.05 37.16 Favored Pre-proline 0 N--CA 1.481 1.086 0 C-N-CA 126.108 1.763 . . . . 0.0 113.256 -169.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.93 164.1 36.5 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.284 3.323 . . . . 0.0 113.949 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 C--O 1.258 1.502 0 C-N-CA 126.232 1.813 . . . . 0.0 113.946 -177.053 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.3 m . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.36 73.17 7.25 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 166.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.7 tp -57.95 -38.63 76.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -167.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -58.98 -52.48 65.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.259 0.936 . . . . 0.0 110.996 172.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -57.1 -42.54 80.96 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 118.913 0.779 . . . . 0.0 112.79 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 89.4 m -63.62 -38.7 92.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.258 1.023 . . . . 0.0 112.691 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -62.43 -46.99 86.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.121 -0.987 . . . . 0.0 112.564 171.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 77.0 mt -58.5 -44.25 89.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.111 0.869 . . . . 0.0 111.06 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.9 m -57.22 -54.52 45.85 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.123 0.969 . . . . 0.0 112.234 174.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.3 m -63.16 -37.61 87.9 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.46 1.027 . . . . 0.0 112.794 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -63.81 -23.8 67.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.599 -1.313 . . . . 0.0 113.745 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 p -66.95 -28.0 67.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 169.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.8 mt -91.13 -5.29 55.28 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.945 2.098 . . . . 0.0 112.757 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.02 55.27 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 126.251 1.881 . . . . 0.0 116.741 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -132.07 177.88 7.22 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.918 1.859 . . . . 0.0 113.971 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.0 mt -78.8 163.69 25.14 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.565 1.146 . . . . 0.0 113.748 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.2 127.07 6.49 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 125.113 1.339 . . . . 0.0 113.076 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -130.87 153.31 49.27 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.141 1.776 . . . . 0.0 111.755 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.2 t -82.48 137.1 34.74 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.897 0.879 . . . . 0.0 111.0 170.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 35.1 mt -130.65 91.95 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.681 1.192 . . . . 0.0 108.714 174.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.97 55.71 25.03 Favored Glycine 0 CA--C 1.529 0.964 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.629 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 64.26 2.79 1.59 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.467 2.307 . . . . 0.0 116.421 -175.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -118.14 118.65 32.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.168 1.387 . . . . 0.0 111.733 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.7 m -62.57 146.11 52.71 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 159.5 43.28 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.305 1.842 . . . . 0.0 111.624 174.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.7 m -100.81 141.11 34.15 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.026 0.93 . . . . 0.0 112.319 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.97 146.53 52.72 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.791 1.236 . . . . 0.0 112.034 -175.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -78.84 162.25 26.8 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.897 2.398 . . . . 0.0 112.073 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.257 1.458 0 C-N-CA 126.061 1.744 . . . . 0.0 114.364 178.601 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 CA--C 1.542 0.653 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -89.58 76.01 7.42 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.114 0.965 . . . . 0.0 110.066 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.62 -40.75 72.55 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.829 1.252 . . . . 0.0 112.834 -172.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -62.83 -46.99 85.33 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.383 0.992 . . . . 0.0 111.93 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -63.2 -38.39 90.97 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.232 -0.917 . . . . 0.0 111.726 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -61.1 -44.31 97.55 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.989 0.915 . . . . 0.0 112.349 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.35 -41.4 93.58 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.212 1.005 . . . . 0.0 112.618 174.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -65.66 -42.41 91.38 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.948 1.249 . . . . 0.0 111.909 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.0 t -60.52 -32.91 71.92 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.865 0.866 . . . . 0.0 112.315 175.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -81.37 -37.55 28.03 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.137 0.975 . . . . 0.0 113.1 171.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.8 tpp180 -64.13 -28.0 69.47 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 119.986 -1.697 . . . . 0.0 111.889 175.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -60.2 -22.08 62.52 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.406 1.482 . . . . 0.0 112.087 169.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -108.63 1.32 21.22 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 127.968 2.507 . . . . 0.0 113.296 174.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.82 14.06 63.66 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.837 1.684 . . . . 0.0 116.888 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -138.2 175.27 9.72 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.681 2.241 . . . . 0.0 114.6 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.1 mt -81.39 168.87 17.89 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.341 1.056 . . . . 0.0 112.015 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -129.29 140.73 11.94 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 124.918 1.247 . . . . 0.0 112.491 173.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -133.27 141.07 47.82 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.951 1.7 . . . . 0.0 111.534 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.9 t -72.37 155.39 40.2 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.677 1.591 . . . . 0.0 113.032 -176.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.9 mt -110.37 -28.0 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 125.975 1.71 . . . . 0.0 112.499 172.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 158.9 -75.19 0.2 Allowed Glycine 0 CA--C 1.53 0.987 0 C-N-CA 127.385 2.421 . . . . 0.0 111.726 174.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -94.18 -28.93 15.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.063 0.945 . . . . 0.0 112.51 169.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -106.33 177.9 4.72 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.158 1.383 . . . . 0.0 111.973 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -144.6 160.87 40.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.675 1.59 . . . . 0.0 111.561 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.39 154.73 35.05 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.975 0.91 . . . . 0.0 113.007 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.59 152.48 39.26 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.799 1.24 . . . . 0.0 113.982 -175.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -144.47 151.7 51.44 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.188 1.795 . . . . 0.0 113.006 -176.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -71.25 162.04 43.78 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.48 2.786 . . . . 0.0 112.8 170.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.486 1.514 . . . . 0.0 113.39 175.357 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.1 t . . . . . 0 CA--C 1.547 0.838 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -75.37 103.59 5.58 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.942 0.792 . . . . 0.0 110.376 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.72 -40.72 95.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.581 0.753 . . . . 0.0 111.993 -177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -43.15 91.34 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.061 0.846 . . . . 0.0 112.396 -175.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -59.82 -35.39 74.61 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.893 1.224 . . . . 0.0 111.346 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.87 -37.46 58.9 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 125.071 1.348 . . . . 0.0 113.804 176.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -58.65 -48.52 80.75 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.645 1.111 . . . . 0.0 111.268 171.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 49.0 mt -61.97 -41.35 97.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.405 1.002 . . . . 0.0 111.732 176.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 64.2 m -61.7 -39.32 91.08 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.418 0.687 . . . . 0.0 112.723 176.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.3 m -80.75 -38.72 28.18 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.163 0.892 . . . . 0.0 113.025 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.7 mmm-85 -63.54 -22.76 67.07 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.363 -1.461 . . . . 0.0 113.48 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.79 -35.27 76.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.373 0.669 . . . . 0.0 111.376 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.0 mt -86.94 -34.27 19.39 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.835 1.654 . . . . 0.0 112.176 175.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 137.53 -5.53 3.48 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 125.494 1.521 . . . . 0.0 116.236 170.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -126.93 174.39 8.87 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.366 1.583 . . . . 0.0 113.556 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 mt -72.58 162.06 29.97 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.976 0.893 . . . . 0.0 112.764 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.04 131.12 7.38 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.859 1.219 . . . . 0.0 111.253 172.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.3 142.36 50.56 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.994 1.718 . . . . 0.0 112.188 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 56.2 m -83.67 82.44 8.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.22 1.408 . . . . 0.0 111.133 170.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.03 115.46 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 O-C-N 121.447 -0.783 . . . . 0.0 109.398 -175.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.7 50.47 63.17 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 122.114 -0.367 . . . . 0.0 112.494 -176.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 55.75 26.95 10.06 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.06 144.1 27.66 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.733 -1.229 . . . . 0.0 112.301 170.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.6 m -77.17 137.82 39.1 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -170.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.46 137.75 44.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.61 1.564 . . . . 0.0 110.465 169.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -81.59 137.24 35.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.974 -0.454 . . . . 0.0 110.709 171.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -142.02 148.26 47.92 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 125.19 1.396 . . . . 0.0 111.854 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.3 164.66 33.24 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.12 2.547 . . . . 0.0 112.362 174.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.573 1.549 . . . . 0.0 112.776 -179.224 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.0 m . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -89.74 72.54 7.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.19 1.396 . . . . 0.0 109.944 169.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.29 -33.36 70.98 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -168.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -62.82 -51.65 66.23 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.504 1.047 . . . . 0.0 111.561 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -57.39 -41.74 80.83 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.162 0.892 . . . . 0.0 110.984 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.93 -46.37 81.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 124.87 1.268 . . . . 0.0 113.715 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.91 -49.69 75.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.099 0.863 . . . . 0.0 112.243 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.91 -38.09 89.82 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.159 0.891 . . . . 0.0 111.754 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -59.74 -52.75 64.17 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.492 0.717 . . . . 0.0 111.645 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.8 m -63.34 -35.35 80.09 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.189 0.904 . . . . 0.0 111.863 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -65.03 -26.15 68.14 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.385 -1.447 . . . . 0.0 113.053 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.6 p -63.96 -18.97 64.79 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.208 0.913 . . . . 0.0 112.848 169.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -107.35 -5.81 17.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.649 2.38 . . . . 0.0 113.599 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.93 16.38 30.87 Favored Glycine 0 CA--C 1.541 1.677 0 N-CA-C 117.235 1.654 . . . . 0.0 117.235 173.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -144.65 169.85 17.21 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.577 1.688 . . . . 0.0 112.868 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.1 mt -77.21 165.86 23.98 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.998 -1.064 . . . . 0.0 113.167 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.93 140.82 13.94 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.997 1.284 . . . . 0.0 111.492 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -140.47 158.67 43.66 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.579 1.952 . . . . 0.0 112.142 176.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -90.6 132.28 35.83 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.31 1.044 . . . . 0.0 112.86 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.7 mt -121.74 103.21 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.625 1.57 . . . . 0.0 108.321 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.1 48.7 81.28 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 123.896 0.76 . . . . 0.0 113.966 176.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.276 79.5 mt-10 64.44 27.3 13.56 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -175.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -146.49 143.07 28.69 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.372 -1.455 . . . . 0.0 110.792 166.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.3 m -84.66 145.36 28.02 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 -169.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.07 146.98 52.41 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.237 2.215 . . . . 0.0 111.656 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.8 m -92.0 138.53 31.46 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.51 0.724 . . . . 0.0 111.23 175.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 m -147.53 153.39 43.55 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 111.34 -169.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.8 155.71 48.73 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.942 2.428 . . . . 0.0 113.408 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.415 1.486 . . . . 0.0 113.127 169.796 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.548 0.866 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -75.59 68.25 2.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.233 1.013 . . . . 0.0 111.209 167.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 tp -49.97 -49.59 49.8 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.452 1.501 . . . . 0.0 112.958 -174.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -61.84 -38.77 89.44 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.195 0.907 . . . . 0.0 112.799 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -65.85 -38.11 87.99 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.793 -0.567 . . . . 0.0 111.895 175.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.5 m -75.43 -30.9 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.737 1.215 . . . . 0.0 113.818 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.71 -43.75 80.9 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.51 1.05 . . . . 0.0 110.916 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.3 mt -64.53 -43.71 93.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.235 1.014 . . . . 0.0 112.014 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 m -60.83 -37.88 83.54 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.78 -25.61 61.23 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.198 -0.939 . . . . 0.0 112.81 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -60.06 -39.19 85.17 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.742 -1.224 . . . . 0.0 110.903 171.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -58.68 -23.26 59.08 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.749 0.82 . . . . 0.0 112.967 173.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.48 -8.4 23.19 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.763 1.625 . . . . 0.0 113.922 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.51 33.78 13.02 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.32 1.438 . . . . 0.0 115.205 175.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.37 -178.24 7.12 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.969 1.308 . . . . 0.0 112.621 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.2 mt -85.0 168.23 15.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.596 1.158 . . . . 0.0 112.953 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.71 146.59 17.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.692 1.139 . . . . 0.0 115.056 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -138.32 163.34 32.07 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 128.146 2.578 . . . . 0.0 111.942 173.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.76 154.39 22.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 172.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mt -136.49 91.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 127.915 2.486 . . . . 0.0 105.581 166.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.8 -128.09 31.59 Favored Glycine 0 CA--C 1.536 1.352 0 O-C-N 121.456 -0.778 . . . . 0.0 111.158 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.2 mp0 -84.97 -4.99 59.35 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.974 1.31 . . . . 0.0 114.339 171.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -100.59 177.47 5.0 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.168 1.787 . . . . 0.0 112.524 175.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.3 m -121.82 161.86 21.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.915 1.286 . . . . 0.0 113.479 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.74 154.58 36.57 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.049 1.739 . . . . 0.0 111.031 169.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 54.5 m -95.28 148.69 22.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.418 0.687 . . . . 0.0 112.676 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -141.95 151.96 60.74 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 126.176 1.79 . . . . 0.0 112.411 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.23 158.42 57.73 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.993 2.462 . . . . 0.0 113.868 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.458 1.903 . . . . 0.0 112.906 176.243 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.8 t . . . . . 0 CA--C 1.544 0.735 0 CA-C-O 119.726 -0.178 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -90.81 120.16 31.62 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.778 -1.201 . . . . 0.0 110.984 174.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -74.09 -48.95 26.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.482 0.713 . . . . 0.0 112.696 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.7 ttp180 -62.74 -43.4 98.89 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.198 -0.939 . . . . 0.0 112.354 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -59.27 -37.7 78.28 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.867 0.758 . . . . 0.0 111.099 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -72.43 -36.83 68.68 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.12 1.368 . . . . 0.0 114.395 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -58.56 -47.44 84.24 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.701 1.592 . . . . 0.0 111.733 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -65.55 -36.32 83.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.17 . . . . 0.0 112.5 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -49.18 68.85 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.965 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.5 m -65.84 -23.32 66.65 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.191 -0.943 . . . . 0.0 112.772 175.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -62.33 -31.65 72.3 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.656 -1.277 . . . . 0.0 113.195 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.7 m -67.97 -26.36 65.89 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 169.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.4 mt -85.68 -7.07 59.02 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.244 1.017 . . . . 0.0 112.614 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.29 21.06 39.47 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.842 1.687 . . . . 0.0 115.575 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -149.89 -179.71 7.35 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 119.695 1.748 . . . . 0.0 113.598 -177.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.8 mt -81.37 170.65 15.73 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.161 1.384 . . . . 0.0 112.09 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.49 141.92 12.81 Favored Glycine 0 N--CA 1.472 1.06 0 C-N-CA 124.647 1.117 . . . . 0.0 113.547 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -129.19 151.34 49.96 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 127.007 2.123 . . . . 0.0 111.912 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 m -97.05 135.34 39.18 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.851 1.26 . . . . 0.0 110.672 169.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.6 mt -136.53 110.81 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.788 0.835 . . . . 0.0 109.219 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.84 -127.22 43.84 Favored Glycine 0 CA--C 1.532 1.149 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -83.33 -2.33 55.47 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -152.52 155.83 38.2 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 120.886 1.675 . . . . 0.0 115.355 -170.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -88.08 160.87 17.63 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -142.81 145.17 32.95 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.353 1.861 . . . . 0.0 111.55 168.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.5 m -91.46 143.59 26.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.718 0.807 . . . . 0.0 112.026 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.6 m -141.63 149.5 54.0 Favored Pre-proline 0 N--CA 1.48 1.059 0 C-N-CA 125.266 1.426 . . . . 0.0 112.744 -168.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.24 156.07 65.79 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.417 2.745 . . . . 0.0 113.407 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.256 1.422 . . . . 0.0 111.846 171.487 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 CA--C 1.541 0.609 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -99.73 114.3 27.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.295 1.038 . . . . 0.0 110.193 169.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -58.46 -42.64 87.91 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 tpp85 -61.42 -41.57 97.37 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.742 0.701 . . . . 0.0 112.624 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -60.26 -38.7 84.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.235 0.925 . . . . 0.0 111.454 175.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.9 m -68.78 -37.8 79.57 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.939 0.896 . . . . 0.0 112.634 174.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -59.15 -45.4 91.07 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.381 1.446 . . . . 0.0 112.911 171.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.4 mt -69.63 -31.02 68.88 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.793 0.837 . . . . 0.0 112.453 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 -39.85 82.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.695 0.798 . . . . 0.0 112.344 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.5 m -71.21 -22.03 62.06 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.348 -0.845 . . . . 0.0 112.459 170.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -64.61 -30.77 71.79 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.508 -1.37 . . . . 0.0 112.225 174.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.7 m -65.69 -9.36 26.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.563 1.145 . . . . 0.0 113.473 168.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.3 mt -119.36 -6.81 10.29 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.184 2.193 . . . . 0.0 112.939 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.52 29.47 24.29 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.058 1.313 . . . . 0.0 116.039 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.87 -179.94 7.9 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.276 1.538 . . . . 0.0 113.55 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.04 176.72 7.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.03 1.732 . . . . 0.0 111.826 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.73 151.01 22.42 Favored Glycine 0 CA--C 1.533 1.164 0 N-CA-C 116.245 1.258 . . . . 0.0 116.245 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -120.83 164.93 15.88 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.478 2.311 . . . . 0.0 112.014 -177.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.1 t -123.24 129.97 52.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.001 1.72 . . . . 0.0 112.377 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -127.26 95.32 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 127.302 2.241 . . . . 0.0 108.019 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.1 -85.93 0.06 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.042 1.306 . . . . 0.0 113.604 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -125.91 0.11 7.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.262 1.825 . . . . 0.0 114.358 -177.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -132.19 171.43 13.67 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.41 1.884 . . . . 0.0 111.023 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 59.5 m -132.79 167.79 19.53 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -172.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.65 125.89 14.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.6 m -74.51 143.77 44.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.487 0.715 . . . . 0.0 111.712 171.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.33 150.15 54.01 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 127.204 2.201 . . . . 0.0 111.19 -172.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -73.88 166.52 29.49 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.475 2.783 . . . . 0.0 113.652 -177.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 C--O 1.245 0.838 0 C-N-CA 124.438 1.095 . . . . 0.0 110.345 167.835 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.3 m . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.78 77.28 7.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.505 1.122 . . . . 0.0 108.046 167.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -43.11 54.32 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.497 1.519 . . . . 0.0 114.491 -167.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.84 -47.08 84.93 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.414 1.006 . . . . 0.0 111.975 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.24 -33.44 76.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.439 1.095 . . . . 0.0 111.434 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.29 -48.27 68.15 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.919 0.888 . . . . 0.0 112.786 170.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -61.53 -43.93 97.97 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.935 -1.103 . . . . 0.0 112.843 177.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.35 -37.69 88.41 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.548 1.067 . . . . 0.0 112.48 176.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 t -63.11 -49.67 73.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.821 0.848 . . . . 0.0 111.885 173.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.3 m -67.44 -42.87 82.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.471 -0.768 . . . . 0.0 111.904 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtp85 -64.07 -20.16 65.74 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.294 -1.504 . . . . 0.0 113.886 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 t -64.72 -31.29 72.44 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.608 0.64 . . . . 0.0 111.881 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -88.98 -16.94 30.51 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.911 1.684 . . . . 0.0 112.727 170.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.4 39.97 5.21 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.828 1.68 . . . . 0.0 115.097 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -147.63 171.62 15.33 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 118.846 1.323 . . . . 0.0 112.046 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.09 165.14 24.99 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.549 1.14 . . . . 0.0 113.251 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -119.97 136.53 11.73 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.242 1.401 . . . . 0.0 112.005 168.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -132.26 143.07 49.65 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.158 1.783 . . . . 0.0 112.024 175.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -81.57 130.62 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.093 0.957 . . . . 0.0 111.586 173.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 23' ' ' GLY . 3.3 mt -93.38 -136.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.198 1.399 . . . . 0.0 107.927 171.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.405 ' H ' HG22 ' A' ' 22' ' ' ILE . . . -76.57 81.75 1.09 Allowed Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.68 1.61 . . . . 0.0 112.227 170.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 57.41 31.36 20.08 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.672 1.989 . . . . 0.0 114.245 177.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -152.27 139.93 19.81 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.988 2.115 . . . . 0.0 109.181 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.7 t -96.49 153.62 17.74 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.04 157.12 42.43 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.559 1.144 . . . . 0.0 112.927 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.8 m -88.74 139.91 29.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -147.03 151.36 41.15 Favored Pre-proline 0 N--CA 1.484 1.253 0 C-N-CA 126.969 2.108 . . . . 0.0 112.725 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.22 160.98 47.7 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.781 2.987 . . . . 0.0 114.152 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.78 1.632 . . . . 0.0 112.372 175.194 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.1 p . . . . . 0 CA--C 1.548 0.904 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -53.29 128.25 27.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.308 1.843 . . . . 0.0 113.153 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.62 -41.44 99.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.946 1.298 . . . . 0.0 111.935 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -62.07 -49.63 75.18 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.213 0.915 . . . . 0.0 111.25 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -59.15 -42.07 89.82 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.629 0.65 . . . . 0.0 111.205 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -65.19 -43.18 92.46 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -57.62 -52.7 64.37 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.304 -0.873 . . . . 0.0 111.431 174.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.78 -37.88 85.98 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 118.985 0.811 . . . . 0.0 112.001 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.06 -42.26 99.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.157 0.983 . . . . 0.0 112.301 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.7 m -75.69 -33.39 60.36 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 121.328 -0.858 . . . . 0.0 112.99 175.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -66.5 -16.93 64.51 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 120.252 -1.53 . . . . 0.0 113.408 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.7 t -66.21 -22.92 66.36 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.733 1.213 . . . . 0.0 112.437 167.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -98.66 -26.19 14.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.277 2.231 . . . . 0.0 112.031 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 129.2 -2.41 6.24 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.56 2.028 . . . . 0.0 116.787 169.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -134.64 174.18 10.84 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.721 1.761 . . . . 0.0 113.742 -169.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.2 175.22 7.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.074 0.95 . . . . 0.0 112.382 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -155.17 152.79 24.27 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.506 -0.746 . . . . 0.0 114.271 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -127.21 157.75 38.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.399 2.279 . . . . 0.0 110.152 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -82.64 144.09 30.53 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.538 0.608 . . . . 0.0 112.534 172.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -131.82 115.75 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 126.375 1.87 . . . . 0.0 108.746 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.0 -86.28 0.3 Allowed Glycine 0 CA--C 1.534 1.253 0 C-N-CA 124.4 1.0 . . . . 0.0 111.708 -172.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -141.29 14.95 2.22 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.577 1.951 . . . . 0.0 112.772 169.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -125.96 140.19 52.82 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.878 -1.139 . . . . 0.0 112.276 -169.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.5 t -74.66 142.47 44.51 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.29 -0.882 . . . . 0.0 113.028 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.58 132.13 25.41 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.751 1.62 . . . . 0.0 111.163 173.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.9 m -88.45 148.54 24.14 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.762 1.225 . . . . 0.0 113.898 -169.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.4 m -142.94 146.9 39.29 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.373 1.869 . . . . 0.0 112.172 -170.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -66.8 153.25 78.58 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.046 2.498 . . . . 0.0 113.652 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 . . . . . 0 C--O 1.254 1.299 0 CA-C-O 117.933 -1.032 . . . . 0.0 111.225 169.92 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.5 t . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -100.96 123.7 45.55 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 166.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.56 -41.4 98.42 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -57.91 -49.04 78.1 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.022 0.929 . . . . 0.0 111.999 172.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -64.04 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.789 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -65.81 -45.12 83.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.647 1.179 . . . . 0.0 112.58 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.31 -48.93 75.69 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.928 -1.107 . . . . 0.0 111.666 173.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.0 mt -59.65 -42.49 92.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.558 0.743 . . . . 0.0 111.871 175.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.9 t -60.13 -46.83 88.31 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.16 0.584 . . . . 0.0 111.409 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.1 m -73.97 -25.94 60.2 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -60.91 -31.52 71.03 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.819 -1.176 . . . . 0.0 112.855 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -66.58 -27.85 68.05 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.044 0.937 . . . . 0.0 112.342 172.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.98 -4.11 50.25 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.786 2.034 . . . . 0.0 113.99 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.67 20.81 46.06 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.297 1.427 . . . . 0.0 116.262 173.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -148.9 174.02 12.69 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.154 1.477 . . . . 0.0 113.363 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.5 mt -74.83 168.25 20.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.979 1.312 . . . . 0.0 112.311 -177.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.86 137.07 8.86 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.452 1.025 . . . . 0.0 113.604 176.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -127.36 155.69 43.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 128.075 2.55 . . . . 0.0 111.718 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 70.7 m -94.06 127.23 39.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.792 0.437 . . . . 0.0 110.699 169.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.0 mt -143.66 127.33 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 126.532 1.933 . . . . 0.0 109.236 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.09 22.22 70.5 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 114.304 -174.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.265 27.0 mt-10 62.32 25.3 15.11 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.908 2.083 . . . . 0.0 112.6 -170.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -126.93 160.04 32.23 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.088 2.955 . . . . 0.0 110.386 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.9 t -84.24 139.43 32.37 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 112.468 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.89 130.18 31.31 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.094 1.358 . . . . 0.0 111.026 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -82.19 142.69 31.97 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.563 0.745 . . . . 0.0 110.917 175.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.6 m -139.88 146.49 47.2 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.309 1.044 . . . . 0.0 112.672 -170.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 150.9 54.46 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.329 2.686 . . . . 0.0 112.93 176.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.213 1.405 . . . . 0.0 111.036 169.214 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -91.55 120.97 32.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.458 0.703 . . . . 0.0 109.96 170.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 66.1 tp -67.41 -41.81 84.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.591 0.756 . . . . 0.0 112.627 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.262 0.1 OUTLIER -65.56 -38.75 90.49 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.943 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -69.57 -33.19 72.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.48 1.036 . . . . 0.0 112.628 170.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.41 -41.68 98.73 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.595 1.089 . . . . 0.0 110.789 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.36 -43.02 99.57 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.062 -1.024 . . . . 0.0 113.118 171.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.84 -37.62 87.56 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 120.462 1.483 . . . . 0.0 112.882 172.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.4 m -63.16 -48.44 78.4 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.497 1.119 . . . . 0.0 110.472 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -80.35 -26.48 38.65 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.885 1.274 . . . . 0.0 114.346 -177.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -61.86 -33.74 74.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.385 1.448 . . . . 0.0 112.485 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -66.19 -11.17 47.99 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.26 1.424 . . . . 0.0 113.815 171.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.96 -1.16 20.88 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.143 2.177 . . . . 0.0 112.288 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.96 0.21 62.13 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.838 2.161 . . . . 0.0 116.609 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.56 178.84 7.04 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.486 1.643 . . . . 0.0 114.42 -169.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 mt -78.86 161.8 26.5 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.203 -0.936 . . . . 0.0 112.778 -176.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.68 139.77 15.88 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.999 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -133.16 146.91 51.98 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.039 2.136 . . . . 0.0 109.659 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 97.4 m -84.3 134.26 34.52 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 119.38 0.991 . . . . 0.0 110.096 167.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -128.86 126.28 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.968 1.707 . . . . 0.0 107.967 177.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.34 -103.04 0.6 Allowed Glycine 0 CA--C 1.531 1.092 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -169.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -134.72 21.75 3.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.586 1.554 . . . . 0.0 113.715 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -132.95 157.16 45.85 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.284 1.433 . . . . 0.0 111.711 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -71.59 146.57 48.32 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.066 0.936 . . . . 0.0 112.018 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.17 120.28 17.71 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.656 1.982 . . . . 0.0 109.203 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -81.73 134.57 35.47 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.806 -0.559 . . . . 0.0 110.171 171.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -142.28 151.56 58.61 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 124.999 1.32 . . . . 0.0 112.488 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.8 166.69 13.35 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.34 2.693 . . . . 0.0 114.219 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.142 1.777 . . . . 0.0 112.948 177.164 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -90.54 116.78 28.71 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.869 -0.52 . . . . 0.0 111.504 174.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.4 -36.8 84.93 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.877 -0.514 . . . . 0.0 112.079 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -62.22 -45.02 95.2 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.301 0.5 . . . . 0.0 111.69 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -61.24 -43.43 98.88 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.951 0.796 . . . . 0.0 112.044 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.77 -44.66 89.32 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 176.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.35 -51.12 70.12 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.228 1.011 . . . . 0.0 112.635 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -60.14 -40.58 90.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.26 1.391 . . . . 0.0 112.043 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -54.51 46.32 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.464 1.106 . . . . 0.0 111.745 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.2 m -64.7 -40.1 94.8 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.187 -0.946 . . . . 0.0 112.514 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -70.32 -21.55 62.9 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.994 -1.066 . . . . 0.0 112.895 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -66.85 -27.1 67.26 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.511 1.051 . . . . 0.0 111.4 170.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -83.83 -43.14 15.68 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.667 1.187 . . . . 0.0 111.166 169.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 139.63 10.5 0.79 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 117.047 1.579 . . . . 0.0 117.047 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -129.79 170.91 13.27 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.074 1.937 . . . . 0.0 111.811 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.0 mt -71.8 163.32 28.03 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.06 0.846 . . . . 0.0 112.014 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.68 149.86 18.76 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.682 1.135 . . . . 0.0 113.862 169.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -135.84 134.35 38.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.507 2.323 . . . . 0.0 110.733 171.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 34.6 m -82.52 150.52 26.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -135.86 83.35 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 124.879 1.272 . . . . 0.0 108.157 175.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.81 -80.82 0.09 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 125.644 1.592 . . . . 0.0 113.151 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -125.22 -5.41 7.26 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.629 1.572 . . . . 0.0 113.898 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -97.2 163.01 13.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.544 1.537 . . . . 0.0 111.659 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.6 t -120.09 147.82 44.37 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.196 1.398 . . . . 0.0 111.631 174.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.18 146.95 31.96 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.768 1.627 . . . . 0.0 111.025 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -105.39 137.51 43.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.322 1.049 . . . . 0.0 111.893 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.47 153.58 76.27 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.953 1.301 . . . . 0.0 113.191 -169.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -72.16 155.43 56.62 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.949 2.433 . . . . 0.0 115.563 -176.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.105 1.762 . . . . 0.0 111.033 168.131 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.546 0.795 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -89.16 69.11 8.28 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.146 0.978 . . . . 0.0 111.039 169.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.43 -46.22 76.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.864 0.866 . . . . 0.0 112.692 -172.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -63.66 -44.03 95.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.324 0.966 . . . . 0.0 112.236 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -59.94 -42.47 94.1 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 119.228 0.922 . . . . 0.0 111.962 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.3 t -62.84 -47.75 82.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.082 1.353 . . . . 0.0 112.304 177.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.75 -53.82 53.33 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.777 0.831 . . . . 0.0 111.824 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -58.99 -36.77 75.46 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 121.283 -0.885 . . . . 0.0 112.252 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.4 t -65.24 -50.74 64.67 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.781 1.233 . . . . 0.0 112.425 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.3 m -68.35 -37.91 80.95 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.104 0.962 . . . . 0.0 112.242 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -65.67 -22.75 66.66 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.838 -1.164 . . . . 0.0 113.659 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.7 t -65.3 -37.0 85.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.713 0.805 . . . . 0.0 111.318 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -75.56 -43.07 50.43 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.904 1.282 . . . . 0.0 111.218 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 141.33 9.27 0.67 Allowed Glycine 0 CA--C 1.539 1.533 0 N-CA-C 116.659 1.423 . . . . 0.0 116.659 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -141.55 171.58 13.86 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.448 1.624 . . . . 0.0 112.228 -174.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -77.05 167.13 22.33 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.62 0.768 . . . . 0.0 112.836 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.47 132.82 10.17 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.322 1.439 . . . . 0.0 111.164 168.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -137.77 140.0 40.38 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 119.198 1.499 . . . . 0.0 112.711 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.6 t -82.7 139.33 33.72 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.903 1.281 . . . . 0.0 113.804 -172.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.9 mt -128.41 103.28 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 126.635 1.974 . . . . 0.0 107.528 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.55 -98.24 0.74 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.592 1.091 . . . . 0.0 112.813 -175.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -128.2 3.87 5.79 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.083 2.153 . . . . 0.0 112.966 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -117.43 151.42 37.1 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.528 1.531 . . . . 0.0 110.787 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.4 t -126.29 149.38 49.17 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.158 -0.963 . . . . 0.0 112.218 -175.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 152.16 38.67 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.443 1.497 . . . . 0.0 112.434 -171.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.0 m -87.04 134.93 33.45 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.114 0.966 . . . . 0.0 113.575 -172.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 m -145.85 150.45 42.82 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.738 1.615 . . . . 0.0 113.834 -170.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.95 159.11 48.74 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.022 3.148 . . . . 0.0 114.85 -175.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.233 1.813 . . . . 0.0 111.672 169.282 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.7 t . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -67.2 89.97 0.2 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.08 1.352 . . . . 0.0 111.353 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -71.59 -38.76 70.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.602 1.561 . . . . 0.0 112.33 -173.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.87 -45.39 78.25 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.192 -0.942 . . . . 0.0 112.629 -178.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -59.8 -36.32 76.5 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-N 119.046 0.839 . . . . 0.0 111.621 177.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.2 t -67.57 -46.17 73.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.668 1.587 . . . . 0.0 113.28 174.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -57.66 -47.81 81.25 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.146 1.339 . . . . 0.0 112.393 175.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 45.5 mt -59.92 -41.0 90.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.282 1.033 . . . . 0.0 111.532 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.6 t -64.52 -48.1 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.688 1.195 . . . . 0.0 112.893 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.5 m -68.98 -27.51 65.78 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.082 -1.012 . . . . 0.0 112.327 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -59.19 -34.77 72.53 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.089 -1.007 . . . . 0.0 112.137 175.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 m -67.63 -18.93 65.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.411 1.084 . . . . 0.0 113.639 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.2 mt -98.54 -3.9 35.4 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.852 2.061 . . . . 0.0 112.639 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.87 57.59 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.72 1.628 . . . . 0.0 115.892 175.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -144.54 176.13 9.62 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.581 1.691 . . . . 0.0 113.578 -178.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.21 172.33 13.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.858 1.263 . . . . 0.0 112.634 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.46 122.45 2.64 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.674 1.131 . . . . 0.0 111.446 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -119.61 148.01 43.85 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.369 1.467 . . . . 0.0 112.307 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.9 t -78.72 127.42 32.05 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.061 0.545 . . . . 0.0 112.454 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -132.18 100.99 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.99 1.316 . . . . 0.0 109.057 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.27 -124.26 15.96 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 121.495 -0.753 . . . . 0.0 111.607 -172.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -88.94 -2.75 58.74 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -137.54 133.45 34.53 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.661 1.184 . . . . 0.0 113.291 -171.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.7 t -88.36 139.63 30.29 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.434 1.094 . . . . 0.0 111.729 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.31 154.46 50.07 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.941 1.296 . . . . 0.0 111.809 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.9 m -78.88 136.62 37.35 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.4 m -148.75 154.29 40.3 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.69 1.596 . . . . 0.0 113.393 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.12 164.05 36.31 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.124 3.216 . . . . 0.0 114.089 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 126.516 1.927 . . . . 0.0 112.992 -177.902 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -108.94 81.83 1.51 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.844 1.658 . . . . 0.0 109.291 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.2 tp -64.98 -40.21 94.62 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.367 1.067 . . . . 0.0 112.41 -170.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -63.06 -46.33 87.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.202 175.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -61.4 -36.64 80.87 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 119.807 1.185 . . . . 0.0 112.312 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.5 -42.44 95.84 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.735 0.814 . . . . 0.0 112.633 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.33 -48.0 83.62 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.066 -1.021 . . . . 0.0 112.22 173.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 mt -62.55 -34.34 76.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.199 1.0 . . . . 0.0 112.327 177.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 t -66.93 -54.75 18.93 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.419 1.488 . . . . 0.0 112.316 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.3 m -71.67 -26.0 62.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.564 0.746 . . . . 0.0 112.944 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -54.45 -38.42 66.32 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.188 1.395 . . . . 0.0 112.411 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.7 m -74.81 -13.57 60.59 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 178.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.8 mt -92.42 -20.5 20.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.172 1.389 . . . . 0.0 111.988 169.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.28 24.23 10.5 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.154 1.359 . . . . 0.0 115.287 178.266 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -146.15 173.48 12.17 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 118.795 1.297 . . . . 0.0 112.913 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 mt -76.29 162.77 27.64 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.26 1.024 . . . . 0.0 112.361 -177.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -127.72 128.07 5.98 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.517 1.056 . . . . 0.0 112.815 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -123.64 159.18 29.86 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.214 2.206 . . . . 0.0 111.834 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.7 m -92.41 127.48 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.707 0.803 . . . . 0.0 110.368 168.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -132.82 112.94 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.48 36.29 90.9 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 121.532 -0.73 . . . . 0.0 112.03 -169.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.25 6.6 mp0 61.0 10.52 2.87 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -178.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -111.35 138.26 48.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.291 1.437 . . . . 0.0 110.36 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.9 t -63.39 130.37 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.809 1.244 . . . . 0.0 112.986 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.72 130.67 47.45 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.169 1.787 . . . . 0.0 110.365 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -87.95 136.48 32.95 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.945 -0.472 . . . . 0.0 111.455 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.94 145.85 52.4 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.183 1.393 . . . . 0.0 112.001 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.49 149.39 91.13 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.934 2.423 . . . . 0.0 113.422 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.325 1.05 . . . . 0.0 111.154 169.589 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 t . . . . . 0 CA--C 1.542 0.641 0 CA-C-O 120.722 0.296 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -76.59 127.24 32.43 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.156 0.982 . . . . 0.0 110.332 172.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.31 -45.61 83.65 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.077 -176.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.1 tpp85 -63.88 -42.23 97.53 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.608 1.095 . . . . 0.0 112.736 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 25.3 ttp85 -54.77 -39.83 68.78 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.104 0.865 . . . . 0.0 111.738 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -70.5 -47.02 62.52 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.929 0.892 . . . . 0.0 112.862 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -56.86 -42.93 80.61 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.68 1.192 . . . . 0.0 112.996 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.6 mt -66.24 -33.87 76.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.749 0.704 . . . . 0.0 112.143 176.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.5 p -66.14 -31.91 73.05 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -87.38 -25.08 24.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.278 1.031 . . . . 0.0 113.335 177.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -56.45 -34.14 66.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.367 1.067 . . . . 0.0 110.973 169.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 m -60.02 -20.53 58.33 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.466 1.506 . . . . 0.0 113.404 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.1 mt -107.31 -13.21 15.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.703 1.601 . . . . 0.0 113.775 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.23 14.83 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.264 1.411 . . . . 0.0 116.237 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.91 -177.22 5.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.097 1.449 . . . . 0.0 112.842 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 mt -74.53 162.56 28.68 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.053 0.941 . . . . 0.0 112.195 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.74 147.92 18.69 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 124.432 1.015 . . . . 0.0 111.959 169.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -147.19 139.35 24.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.407 1.883 . . . . 0.0 111.221 -177.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.98 116.18 27.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.13 0.572 . . . . 0.0 110.435 176.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.7 mt -102.54 109.55 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.487 1.115 . . . . 0.0 108.407 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 -84.2 0.18 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.204 0.906 . . . . 0.0 112.625 -178.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.52 21.97 2.18 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.316 1.446 . . . . 0.0 114.108 171.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -140.56 139.75 35.04 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.908 -1.12 . . . . 0.0 112.979 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.61 139.53 51.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.091 1.356 . . . . 0.0 113.662 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.11 48.39 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.473 1.909 . . . . 0.0 110.332 169.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -102.37 103.08 13.48 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.273 0.629 . . . . 0.0 111.141 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 m -90.21 147.52 37.13 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 123.74 0.816 . . . . 0.0 112.153 -176.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -68.57 163.96 34.83 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.838 2.358 . . . . 0.0 112.982 170.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 C--O 1.254 1.334 0 CA-C-O 117.305 -1.331 . . . . 0.0 113.19 173.855 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.544 0.719 0 CA-C-O 120.565 0.222 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -87.27 113.64 23.18 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.65 0.78 . . . . 0.0 109.848 170.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.04 -41.35 78.5 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.408 1.083 . . . . 0.0 112.641 -176.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.4 mmp_? -58.68 -51.49 69.71 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.169 0.895 . . . . 0.0 112.053 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpm_? -61.48 -38.4 87.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.248 0.619 . . . . 0.0 111.415 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.5 t -63.82 -46.55 84.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.259 1.024 . . . . 0.0 113.084 173.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -57.47 -45.44 84.8 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.566 1.076 . . . . 0.0 112.503 175.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.0 mt -70.58 -33.33 70.98 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.939 0.895 . . . . 0.0 111.922 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 t -65.98 -46.01 79.59 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.581 0.352 . . . . 0.0 111.604 171.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.23 -26.46 68.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.735 -1.228 . . . . 0.0 112.955 175.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -60.33 -30.24 69.39 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.822 -1.174 . . . . 0.0 112.224 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.2 m -68.35 -15.28 63.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 171.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.6 mt -105.15 -10.02 17.39 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.964 1.706 . . . . 0.0 112.893 174.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.71 7.2 39.59 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.726 2.108 . . . . 0.0 116.59 174.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.11 179.71 7.04 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.218 2.009 . . . . 0.0 114.347 -170.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.46 168.54 18.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.943 1.297 . . . . 0.0 112.497 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.57 148.79 19.64 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 124.629 1.109 . . . . 0.0 113.567 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -133.11 151.15 52.02 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.869 2.467 . . . . 0.0 110.772 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 93.2 m -99.31 141.77 31.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.108 0.956 . . . . 0.0 113.395 175.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.9 mt -126.31 172.01 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 C-N-CA 129.64 3.176 . . . . 0.0 106.96 173.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.33 102.81 0.09 OUTLIER Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.409 -1.432 . . . . 0.0 113.842 178.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 51.69 35.4 14.95 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 114.444 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -148.36 134.45 19.26 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.554 1.141 . . . . 0.0 112.299 -177.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.5 t -96.32 134.83 38.97 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.283 1.433 . . . . 0.0 110.408 169.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.33 131.48 43.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.009 1.324 . . . . 0.0 111.898 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -91.44 142.55 27.55 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.909 0.884 . . . . 0.0 111.956 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.25 151.0 57.25 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 125.656 1.582 . . . . 0.0 112.334 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.66 160.8 47.15 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.143 2.562 . . . . 0.0 112.984 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.176 1.39 . . . . 0.0 112.649 175.89 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -83.89 161.65 20.79 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.121 0.969 . . . . 0.0 113.385 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.6 m -62.93 118.7 8.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.868 1.667 . . . . 0.0 113.368 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.01 68.67 8.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.536 -0.728 . . . . 0.0 110.1 166.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.9 tp -50.54 -32.21 17.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.63 1.572 . . . . 0.0 113.379 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -59.01 -54.26 49.15 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.931 0.892 . . . . 0.0 112.191 171.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -67.61 -28.68 67.95 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.152 0.887 . . . . 0.0 112.471 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.6 m -66.31 -46.47 76.8 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 124.691 1.197 . . . . 0.0 112.163 170.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.97 -43.1 86.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.36 -0.829 . . . . 0.0 112.346 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.65 -50.52 72.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.118 0.872 . . . . 0.0 111.828 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.7 m -62.73 -41.31 99.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.495 0.718 . . . . 0.0 112.212 -176.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.0 m -77.8 -21.66 51.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 176.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -59.68 -36.04 75.68 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 120.074 1.307 . . . . 0.0 111.842 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -61.9 -24.85 67.2 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.1 mt -93.93 -4.47 49.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.814 1.646 . . . . 0.0 112.765 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.35 14.32 60.36 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.086 1.803 . . . . 0.0 116.333 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.23 178.8 8.65 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 119.872 1.836 . . . . 0.0 114.595 -172.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.9 mt -72.09 168.91 17.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.524 1.53 . . . . 0.0 112.144 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.84 59.97 0.64 Allowed Glycine 0 N--CA 1.474 1.197 0 C-N-CA 126.306 1.908 . . . . 0.0 113.868 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -66.06 148.67 51.46 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.57 1.948 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.4 t -86.35 120.09 27.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.727 0.811 . . . . 0.0 111.709 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -131.8 112.71 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.079 1.352 . . . . 0.0 109.509 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.45 39.54 97.83 Favored Glycine 0 CA--C 1.535 1.288 0 O-C-N 121.426 -0.796 . . . . 0.0 112.659 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.61 22.13 12.57 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.052 1.741 . . . . 0.0 115.352 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -139.33 149.15 43.87 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.123 1.769 . . . . 0.0 110.296 167.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.4 m -79.45 156.97 27.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -150.72 138.43 19.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.921 1.689 . . . . 0.0 110.599 171.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.8 m -82.6 129.99 35.04 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 111.745 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.4 m -148.97 155.79 40.53 Favored Pre-proline 0 N--CA 1.484 1.244 0 C-N-CA 125.859 1.664 . . . . 0.0 113.472 -173.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -67.43 163.2 35.64 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.888 3.059 . . . . 0.0 115.231 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 127.243 2.217 . . . . 0.0 114.321 177.08 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.603 0.24 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -60.9 156.38 17.58 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -168.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 p -59.0 167.43 1.64 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 126.82 2.048 . . . . 0.0 116.249 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -92.68 87.51 5.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.743 1.617 . . . . 0.0 108.896 168.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.8 tp -67.42 -38.68 84.97 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.755 0.822 . . . . 0.0 112.804 -170.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -65.23 -42.74 93.09 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.655 1.116 . . . . 0.0 112.333 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -55.3 -41.92 72.99 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.369 0.986 . . . . 0.0 111.845 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -64.57 -50.07 68.7 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.372 0.669 . . . . 0.0 111.531 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.02 -42.05 93.48 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.745 -1.222 . . . . 0.0 113.725 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.83 -48.97 72.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.639 1.109 . . . . 0.0 111.775 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 79.1 p -67.35 -32.57 73.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.07 -29.13 62.73 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.491 1.041 . . . . 0.0 113.359 170.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.87 -38.74 89.44 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.848 -1.158 . . . . 0.0 111.424 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -56.05 -33.2 64.77 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.659 0.783 . . . . 0.0 112.266 173.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.5 mt -84.71 -13.34 51.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.166 1.387 . . . . 0.0 112.751 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.83 23.18 13.99 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.577 -1.124 . . . . 0.0 115.829 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -155.31 176.12 12.99 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.01 1.405 . . . . 0.0 113.433 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.82 169.74 17.76 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.301 1.441 . . . . 0.0 113.436 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.89 134.52 9.93 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 110.618 167.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -125.04 136.99 54.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.756 1.622 . . . . 0.0 113.384 172.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.53 127.36 32.44 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.896 1.678 . . . . 0.0 110.376 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -87.71 -31.34 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.119 1.368 . . . . 0.0 111.831 176.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.93 -102.54 0.19 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 128.114 2.768 . . . . 0.0 110.988 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -74.83 -21.98 58.96 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.801 -0.823 . . . . 0.0 112.698 171.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.59 167.52 11.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.6 1.96 . . . . 0.0 110.918 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 152.49 47.81 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.257 1.423 . . . . 0.0 111.284 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.29 154.99 43.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.3 m -79.48 137.59 37.27 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -149.59 156.29 38.97 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 126.078 1.751 . . . . 0.0 112.302 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -62.69 168.65 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.93 3.087 . . . . 0.0 115.23 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.249 1.054 0 C-N-CA 126.664 1.986 . . . . 0.0 112.342 174.049 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.638 0.256 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -94.04 144.35 25.55 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.844 0.857 . . . . 0.0 111.518 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.2 t -77.99 120.57 23.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.144 0.578 . . . . 0.0 112.532 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -74.85 69.8 1.88 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.536 1.135 . . . . 0.0 112.341 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.13 -45.23 75.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.709 1.603 . . . . 0.0 112.568 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -61.21 -47.23 87.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.387 0.675 . . . . 0.0 112.129 178.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 -58.79 -40.71 84.81 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.375 0.67 . . . . 0.0 111.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.06 -50.29 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.61 1.164 . . . . 0.0 112.691 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -59.81 -38.14 81.14 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.633 -1.292 . . . . 0.0 113.2 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.36 -34.59 78.5 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.032 0.833 . . . . 0.0 112.395 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.1 t -65.55 -45.55 82.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.459 0.304 . . . . 0.0 111.7 170.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.4 m -70.19 -28.38 65.26 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mtp180 -58.62 -32.49 69.07 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.663 1.185 . . . . 0.0 113.161 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -78.3 0.51 25.12 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 175.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.4 mt -123.83 -3.19 8.21 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 127.147 2.179 . . . . 0.0 113.577 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 13.67 58.92 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.62 1.581 . . . . 0.0 116.969 173.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -145.72 -179.58 6.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.826 1.813 . . . . 0.0 114.54 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 69.0 mt -83.08 169.87 15.42 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.385 1.474 . . . . 0.0 112.825 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.89 129.41 6.56 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.01 1.291 . . . . 0.0 112.038 169.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -124.04 141.81 51.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.962 1.305 . . . . 0.0 113.5 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 99.4 m -81.73 146.06 30.17 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.448 1.499 . . . . 0.0 112.505 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -103.74 -26.61 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-O 123.466 1.603 . . . . 0.0 112.804 -177.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.34 -48.92 0.21 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 128.08 2.752 . . . . 0.0 111.832 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -139.18 -18.55 1.0 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 169.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -101.53 166.94 10.45 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.589 1.555 . . . . 0.0 110.614 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.5 t -136.17 160.31 39.05 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.986 1.314 . . . . 0.0 112.673 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.29 150.28 35.45 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.341 1.456 . . . . 0.0 112.181 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.7 m -81.03 136.31 35.96 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -149.72 154.05 37.16 Favored Pre-proline 0 N--CA 1.481 1.086 0 C-N-CA 126.108 1.763 . . . . 0.0 113.256 -169.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.93 164.1 36.5 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.284 3.323 . . . . 0.0 113.949 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 C--O 1.258 1.502 0 C-N-CA 126.232 1.813 . . . . 0.0 113.946 -177.053 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 119.598 -0.239 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -138.47 140.34 39.18 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.272 1.829 . . . . 0.0 110.603 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.3 m -88.77 109.7 20.39 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.487 1.039 . . . . 0.0 113.497 -179.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.36 73.17 7.25 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 166.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.7 tp -57.95 -38.63 76.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -167.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -58.98 -52.48 65.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.259 0.936 . . . . 0.0 110.996 172.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -57.1 -42.54 80.96 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 118.913 0.779 . . . . 0.0 112.79 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 89.4 m -63.62 -38.7 92.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.258 1.023 . . . . 0.0 112.691 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -62.43 -46.99 86.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.121 -0.987 . . . . 0.0 112.564 171.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 77.0 mt -58.5 -44.25 89.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.111 0.869 . . . . 0.0 111.06 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.9 m -57.22 -54.52 45.85 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.123 0.969 . . . . 0.0 112.234 174.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.3 m -63.16 -37.61 87.9 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.46 1.027 . . . . 0.0 112.794 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -63.81 -23.8 67.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.599 -1.313 . . . . 0.0 113.745 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 p -66.95 -28.0 67.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 169.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.8 mt -91.13 -5.29 55.28 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.945 2.098 . . . . 0.0 112.757 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.02 55.27 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 126.251 1.881 . . . . 0.0 116.741 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -132.07 177.88 7.22 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.918 1.859 . . . . 0.0 113.971 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.0 mt -78.8 163.69 25.14 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.565 1.146 . . . . 0.0 113.748 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.2 127.07 6.49 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 125.113 1.339 . . . . 0.0 113.076 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -130.87 153.31 49.27 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.141 1.776 . . . . 0.0 111.755 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.2 t -82.48 137.1 34.74 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.897 0.879 . . . . 0.0 111.0 170.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 35.1 mt -130.65 91.95 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.681 1.192 . . . . 0.0 108.714 174.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.97 55.71 25.03 Favored Glycine 0 CA--C 1.529 0.964 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.629 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 64.26 2.79 1.59 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.467 2.307 . . . . 0.0 116.421 -175.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -118.14 118.65 32.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.168 1.387 . . . . 0.0 111.733 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.7 m -62.57 146.11 52.71 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 159.5 43.28 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.305 1.842 . . . . 0.0 111.624 174.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.7 m -100.81 141.11 34.15 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.026 0.93 . . . . 0.0 112.319 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.97 146.53 52.72 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.791 1.236 . . . . 0.0 112.034 -175.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -78.84 162.25 26.8 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.897 2.398 . . . . 0.0 112.073 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.257 1.458 0 C-N-CA 126.061 1.744 . . . . 0.0 114.364 178.601 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -70.85 149.92 46.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.837 0.744 . . . . 0.0 112.823 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.0 p -60.12 135.38 57.7 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -169.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -89.58 76.01 7.42 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.114 0.965 . . . . 0.0 110.066 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.62 -40.75 72.55 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.829 1.252 . . . . 0.0 112.834 -172.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -62.83 -46.99 85.33 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.383 0.992 . . . . 0.0 111.93 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -63.2 -38.39 90.97 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.232 -0.917 . . . . 0.0 111.726 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -61.1 -44.31 97.55 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.989 0.915 . . . . 0.0 112.349 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.35 -41.4 93.58 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.212 1.005 . . . . 0.0 112.618 174.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -65.66 -42.41 91.38 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.948 1.249 . . . . 0.0 111.909 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.0 t -60.52 -32.91 71.92 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.865 0.866 . . . . 0.0 112.315 175.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -81.37 -37.55 28.03 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.137 0.975 . . . . 0.0 113.1 171.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.8 tpp180 -64.13 -28.0 69.47 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 119.986 -1.697 . . . . 0.0 111.889 175.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -60.2 -22.08 62.52 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.406 1.482 . . . . 0.0 112.087 169.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -108.63 1.32 21.22 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 127.968 2.507 . . . . 0.0 113.296 174.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.82 14.06 63.66 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.837 1.684 . . . . 0.0 116.888 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -138.2 175.27 9.72 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.681 2.241 . . . . 0.0 114.6 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.1 mt -81.39 168.87 17.89 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.341 1.056 . . . . 0.0 112.015 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -129.29 140.73 11.94 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 124.918 1.247 . . . . 0.0 112.491 173.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -133.27 141.07 47.82 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.951 1.7 . . . . 0.0 111.534 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.9 t -72.37 155.39 40.2 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.677 1.591 . . . . 0.0 113.032 -176.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.9 mt -110.37 -28.0 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 125.975 1.71 . . . . 0.0 112.499 172.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 158.9 -75.19 0.2 Allowed Glycine 0 CA--C 1.53 0.987 0 C-N-CA 127.385 2.421 . . . . 0.0 111.726 174.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -94.18 -28.93 15.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.063 0.945 . . . . 0.0 112.51 169.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -106.33 177.9 4.72 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.158 1.383 . . . . 0.0 111.973 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -144.6 160.87 40.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.675 1.59 . . . . 0.0 111.561 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.39 154.73 35.05 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.975 0.91 . . . . 0.0 113.007 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.59 152.48 39.26 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.799 1.24 . . . . 0.0 113.982 -175.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -144.47 151.7 51.44 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.188 1.795 . . . . 0.0 113.006 -176.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -71.25 162.04 43.78 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.48 2.786 . . . . 0.0 112.8 170.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.486 1.514 . . . . 0.0 113.39 175.357 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -76.34 151.66 36.59 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -168.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.1 t -75.01 124.85 27.72 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.038 1.735 . . . . 0.0 111.094 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -75.37 103.59 5.58 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.942 0.792 . . . . 0.0 110.376 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.72 -40.72 95.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.581 0.753 . . . . 0.0 111.993 -177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -43.15 91.34 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.061 0.846 . . . . 0.0 112.396 -175.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -59.82 -35.39 74.61 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.893 1.224 . . . . 0.0 111.346 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.87 -37.46 58.9 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 125.071 1.348 . . . . 0.0 113.804 176.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -58.65 -48.52 80.75 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.645 1.111 . . . . 0.0 111.268 171.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 49.0 mt -61.97 -41.35 97.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.405 1.002 . . . . 0.0 111.732 176.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 64.2 m -61.7 -39.32 91.08 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.418 0.687 . . . . 0.0 112.723 176.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.3 m -80.75 -38.72 28.18 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.163 0.892 . . . . 0.0 113.025 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.7 mmm-85 -63.54 -22.76 67.07 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.363 -1.461 . . . . 0.0 113.48 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.79 -35.27 76.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.373 0.669 . . . . 0.0 111.376 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.0 mt -86.94 -34.27 19.39 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.835 1.654 . . . . 0.0 112.176 175.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 137.53 -5.53 3.48 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 125.494 1.521 . . . . 0.0 116.236 170.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -126.93 174.39 8.87 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.366 1.583 . . . . 0.0 113.556 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 mt -72.58 162.06 29.97 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.976 0.893 . . . . 0.0 112.764 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.04 131.12 7.38 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.859 1.219 . . . . 0.0 111.253 172.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.3 142.36 50.56 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.994 1.718 . . . . 0.0 112.188 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 56.2 m -83.67 82.44 8.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.22 1.408 . . . . 0.0 111.133 170.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.03 115.46 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 O-C-N 121.447 -0.783 . . . . 0.0 109.398 -175.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.7 50.47 63.17 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 122.114 -0.367 . . . . 0.0 112.494 -176.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 55.75 26.95 10.06 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.06 144.1 27.66 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.733 -1.229 . . . . 0.0 112.301 170.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.6 m -77.17 137.82 39.1 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -170.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.46 137.75 44.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.61 1.564 . . . . 0.0 110.465 169.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -81.59 137.24 35.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.974 -0.454 . . . . 0.0 110.709 171.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -142.02 148.26 47.92 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 125.19 1.396 . . . . 0.0 111.854 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.3 164.66 33.24 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.12 2.547 . . . . 0.0 112.362 174.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.573 1.549 . . . . 0.0 112.776 -179.224 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -67.39 154.18 41.95 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 -167.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.0 m -56.98 146.89 25.5 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.333 1.453 . . . . 0.0 113.426 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -89.74 72.54 7.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.19 1.396 . . . . 0.0 109.944 169.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.29 -33.36 70.98 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -168.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -62.82 -51.65 66.23 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.504 1.047 . . . . 0.0 111.561 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -57.39 -41.74 80.83 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.162 0.892 . . . . 0.0 110.984 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.93 -46.37 81.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 124.87 1.268 . . . . 0.0 113.715 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.91 -49.69 75.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.099 0.863 . . . . 0.0 112.243 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.91 -38.09 89.82 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.159 0.891 . . . . 0.0 111.754 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -59.74 -52.75 64.17 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.492 0.717 . . . . 0.0 111.645 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.8 m -63.34 -35.35 80.09 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.189 0.904 . . . . 0.0 111.863 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -65.03 -26.15 68.14 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.385 -1.447 . . . . 0.0 113.053 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.6 p -63.96 -18.97 64.79 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.208 0.913 . . . . 0.0 112.848 169.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -107.35 -5.81 17.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.649 2.38 . . . . 0.0 113.599 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.93 16.38 30.87 Favored Glycine 0 CA--C 1.541 1.677 0 N-CA-C 117.235 1.654 . . . . 0.0 117.235 173.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -144.65 169.85 17.21 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.577 1.688 . . . . 0.0 112.868 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.1 mt -77.21 165.86 23.98 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.998 -1.064 . . . . 0.0 113.167 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.93 140.82 13.94 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.997 1.284 . . . . 0.0 111.492 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -140.47 158.67 43.66 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.579 1.952 . . . . 0.0 112.142 176.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -90.6 132.28 35.83 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.31 1.044 . . . . 0.0 112.86 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.7 mt -121.74 103.21 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.625 1.57 . . . . 0.0 108.321 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.1 48.7 81.28 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 123.896 0.76 . . . . 0.0 113.966 176.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.276 79.5 mt-10 64.44 27.3 13.56 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -175.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -146.49 143.07 28.69 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.372 -1.455 . . . . 0.0 110.792 166.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.3 m -84.66 145.36 28.02 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 -169.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.07 146.98 52.41 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.237 2.215 . . . . 0.0 111.656 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.8 m -92.0 138.53 31.46 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.51 0.724 . . . . 0.0 111.23 175.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 m -147.53 153.39 43.55 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 111.34 -169.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.8 155.71 48.73 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.942 2.428 . . . . 0.0 113.408 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.415 1.486 . . . . 0.0 113.127 169.796 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.208 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -93.66 169.22 10.49 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.345 1.458 . . . . 0.0 113.018 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 p -87.18 174.24 8.74 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.876 2.07 . . . . 0.0 114.365 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -75.59 68.25 2.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.233 1.013 . . . . 0.0 111.209 167.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 tp -49.97 -49.59 49.8 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.452 1.501 . . . . 0.0 112.958 -174.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -61.84 -38.77 89.44 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.195 0.907 . . . . 0.0 112.799 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -65.85 -38.11 87.99 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.793 -0.567 . . . . 0.0 111.895 175.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.5 m -75.43 -30.9 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.737 1.215 . . . . 0.0 113.818 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.71 -43.75 80.9 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.51 1.05 . . . . 0.0 110.916 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.3 mt -64.53 -43.71 93.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.235 1.014 . . . . 0.0 112.014 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 m -60.83 -37.88 83.54 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.78 -25.61 61.23 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.198 -0.939 . . . . 0.0 112.81 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -60.06 -39.19 85.17 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.742 -1.224 . . . . 0.0 110.903 171.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -58.68 -23.26 59.08 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.749 0.82 . . . . 0.0 112.967 173.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.48 -8.4 23.19 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.763 1.625 . . . . 0.0 113.922 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.51 33.78 13.02 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.32 1.438 . . . . 0.0 115.205 175.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.37 -178.24 7.12 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.969 1.308 . . . . 0.0 112.621 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.2 mt -85.0 168.23 15.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.596 1.158 . . . . 0.0 112.953 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.71 146.59 17.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.692 1.139 . . . . 0.0 115.056 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -138.32 163.34 32.07 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 128.146 2.578 . . . . 0.0 111.942 173.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.76 154.39 22.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 172.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mt -136.49 91.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 127.915 2.486 . . . . 0.0 105.581 166.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.8 -128.09 31.59 Favored Glycine 0 CA--C 1.536 1.352 0 O-C-N 121.456 -0.778 . . . . 0.0 111.158 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.2 mp0 -84.97 -4.99 59.35 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.974 1.31 . . . . 0.0 114.339 171.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -100.59 177.47 5.0 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.168 1.787 . . . . 0.0 112.524 175.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.3 m -121.82 161.86 21.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.915 1.286 . . . . 0.0 113.479 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.74 154.58 36.57 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.049 1.739 . . . . 0.0 111.031 169.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 54.5 m -95.28 148.69 22.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.418 0.687 . . . . 0.0 112.676 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -141.95 151.96 60.74 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 126.176 1.79 . . . . 0.0 112.411 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.23 158.42 57.73 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.993 2.462 . . . . 0.0 113.868 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.458 1.903 . . . . 0.0 112.906 176.243 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -68.06 140.06 56.27 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.771 0.796 . . . . 0.0 113.067 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.8 t -66.34 132.71 48.96 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.119 1.368 . . . . 0.0 111.069 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -90.81 120.16 31.62 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.778 -1.201 . . . . 0.0 110.984 174.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -74.09 -48.95 26.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.482 0.713 . . . . 0.0 112.696 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.7 ttp180 -62.74 -43.4 98.89 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.198 -0.939 . . . . 0.0 112.354 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -59.27 -37.7 78.28 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.867 0.758 . . . . 0.0 111.099 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -72.43 -36.83 68.68 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.12 1.368 . . . . 0.0 114.395 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -58.56 -47.44 84.24 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.701 1.592 . . . . 0.0 111.733 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -65.55 -36.32 83.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.17 . . . . 0.0 112.5 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -49.18 68.85 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.965 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.5 m -65.84 -23.32 66.65 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.191 -0.943 . . . . 0.0 112.772 175.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -62.33 -31.65 72.3 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.656 -1.277 . . . . 0.0 113.195 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.7 m -67.97 -26.36 65.89 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 169.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.4 mt -85.68 -7.07 59.02 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.244 1.017 . . . . 0.0 112.614 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.29 21.06 39.47 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.842 1.687 . . . . 0.0 115.575 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -149.89 -179.71 7.35 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 119.695 1.748 . . . . 0.0 113.598 -177.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.8 mt -81.37 170.65 15.73 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.161 1.384 . . . . 0.0 112.09 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.49 141.92 12.81 Favored Glycine 0 N--CA 1.472 1.06 0 C-N-CA 124.647 1.117 . . . . 0.0 113.547 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -129.19 151.34 49.96 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 127.007 2.123 . . . . 0.0 111.912 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 m -97.05 135.34 39.18 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.851 1.26 . . . . 0.0 110.672 169.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.6 mt -136.53 110.81 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.788 0.835 . . . . 0.0 109.219 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.84 -127.22 43.84 Favored Glycine 0 CA--C 1.532 1.149 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -83.33 -2.33 55.47 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -152.52 155.83 38.2 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 120.886 1.675 . . . . 0.0 115.355 -170.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -88.08 160.87 17.63 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -142.81 145.17 32.95 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.353 1.861 . . . . 0.0 111.55 168.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.5 m -91.46 143.59 26.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.718 0.807 . . . . 0.0 112.026 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.6 m -141.63 149.5 54.0 Favored Pre-proline 0 N--CA 1.48 1.059 0 C-N-CA 125.266 1.426 . . . . 0.0 112.744 -168.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.24 156.07 65.79 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.417 2.745 . . . . 0.0 113.407 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.256 1.422 . . . . 0.0 111.846 171.487 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.555 0.217 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -56.84 145.35 29.9 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.452 1.101 . . . . 0.0 113.395 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 p -79.51 148.61 31.75 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -99.73 114.3 27.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.295 1.038 . . . . 0.0 110.193 169.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -58.46 -42.64 87.91 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 tpp85 -61.42 -41.57 97.37 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.742 0.701 . . . . 0.0 112.624 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -60.26 -38.7 84.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.235 0.925 . . . . 0.0 111.454 175.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.9 m -68.78 -37.8 79.57 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.939 0.896 . . . . 0.0 112.634 174.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -59.15 -45.4 91.07 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.381 1.446 . . . . 0.0 112.911 171.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.4 mt -69.63 -31.02 68.88 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.793 0.837 . . . . 0.0 112.453 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 -39.85 82.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.695 0.798 . . . . 0.0 112.344 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.5 m -71.21 -22.03 62.06 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.348 -0.845 . . . . 0.0 112.459 170.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -64.61 -30.77 71.79 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.508 -1.37 . . . . 0.0 112.225 174.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.7 m -65.69 -9.36 26.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.563 1.145 . . . . 0.0 113.473 168.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.3 mt -119.36 -6.81 10.29 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.184 2.193 . . . . 0.0 112.939 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.52 29.47 24.29 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.058 1.313 . . . . 0.0 116.039 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.87 -179.94 7.9 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.276 1.538 . . . . 0.0 113.55 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.04 176.72 7.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.03 1.732 . . . . 0.0 111.826 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.73 151.01 22.42 Favored Glycine 0 CA--C 1.533 1.164 0 N-CA-C 116.245 1.258 . . . . 0.0 116.245 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -120.83 164.93 15.88 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.478 2.311 . . . . 0.0 112.014 -177.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.1 t -123.24 129.97 52.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.001 1.72 . . . . 0.0 112.377 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -127.26 95.32 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 127.302 2.241 . . . . 0.0 108.019 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.1 -85.93 0.06 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.042 1.306 . . . . 0.0 113.604 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -125.91 0.11 7.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.262 1.825 . . . . 0.0 114.358 -177.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -132.19 171.43 13.67 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.41 1.884 . . . . 0.0 111.023 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 59.5 m -132.79 167.79 19.53 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -172.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.65 125.89 14.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.6 m -74.51 143.77 44.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.487 0.715 . . . . 0.0 111.712 171.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.33 150.15 54.01 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 127.204 2.201 . . . . 0.0 111.19 -172.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -73.88 166.52 29.49 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.475 2.783 . . . . 0.0 113.652 -177.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 C--O 1.245 0.838 0 C-N-CA 124.438 1.095 . . . . 0.0 110.345 167.835 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -47.19 138.23 7.2 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -167.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.3 m -68.18 95.17 0.56 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.494 2.718 . . . . 0.0 113.961 -174.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.78 77.28 7.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.505 1.122 . . . . 0.0 108.046 167.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -43.11 54.32 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.497 1.519 . . . . 0.0 114.491 -167.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.84 -47.08 84.93 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.414 1.006 . . . . 0.0 111.975 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.24 -33.44 76.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.439 1.095 . . . . 0.0 111.434 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.29 -48.27 68.15 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.919 0.888 . . . . 0.0 112.786 170.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -61.53 -43.93 97.97 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.935 -1.103 . . . . 0.0 112.843 177.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.35 -37.69 88.41 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.548 1.067 . . . . 0.0 112.48 176.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 t -63.11 -49.67 73.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.821 0.848 . . . . 0.0 111.885 173.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.3 m -67.44 -42.87 82.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.471 -0.768 . . . . 0.0 111.904 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtp85 -64.07 -20.16 65.74 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.294 -1.504 . . . . 0.0 113.886 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 t -64.72 -31.29 72.44 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.608 0.64 . . . . 0.0 111.881 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -88.98 -16.94 30.51 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.911 1.684 . . . . 0.0 112.727 170.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.4 39.97 5.21 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.828 1.68 . . . . 0.0 115.097 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -147.63 171.62 15.33 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 118.846 1.323 . . . . 0.0 112.046 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.09 165.14 24.99 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.549 1.14 . . . . 0.0 113.251 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -119.97 136.53 11.73 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.242 1.401 . . . . 0.0 112.005 168.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -132.26 143.07 49.65 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.158 1.783 . . . . 0.0 112.024 175.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -81.57 130.62 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.093 0.957 . . . . 0.0 111.586 173.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 23' ' ' GLY . 3.3 mt -93.38 -136.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.198 1.399 . . . . 0.0 107.927 171.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.405 ' H ' HG22 ' A' ' 22' ' ' ILE . . . -76.57 81.75 1.09 Allowed Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.68 1.61 . . . . 0.0 112.227 170.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 57.41 31.36 20.08 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.672 1.989 . . . . 0.0 114.245 177.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -152.27 139.93 19.81 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.988 2.115 . . . . 0.0 109.181 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.7 t -96.49 153.62 17.74 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.04 157.12 42.43 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.559 1.144 . . . . 0.0 112.927 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.8 m -88.74 139.91 29.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -147.03 151.36 41.15 Favored Pre-proline 0 N--CA 1.484 1.253 0 C-N-CA 126.969 2.108 . . . . 0.0 112.725 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.22 160.98 47.7 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.781 2.987 . . . . 0.0 114.152 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.78 1.632 . . . . 0.0 112.372 175.194 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.769 0 CA-C-O 120.699 0.285 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -136.33 156.36 48.76 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.933 2.093 . . . . 0.0 107.592 172.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.1 p -71.05 67.84 0.43 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -172.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -53.29 128.25 27.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.308 1.843 . . . . 0.0 113.153 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.62 -41.44 99.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.946 1.298 . . . . 0.0 111.935 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -62.07 -49.63 75.18 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.213 0.915 . . . . 0.0 111.25 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -59.15 -42.07 89.82 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.629 0.65 . . . . 0.0 111.205 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -65.19 -43.18 92.46 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -57.62 -52.7 64.37 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.304 -0.873 . . . . 0.0 111.431 174.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.78 -37.88 85.98 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 118.985 0.811 . . . . 0.0 112.001 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.06 -42.26 99.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.157 0.983 . . . . 0.0 112.301 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.7 m -75.69 -33.39 60.36 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 121.328 -0.858 . . . . 0.0 112.99 175.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -66.5 -16.93 64.51 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 120.252 -1.53 . . . . 0.0 113.408 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.7 t -66.21 -22.92 66.36 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.733 1.213 . . . . 0.0 112.437 167.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -98.66 -26.19 14.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.277 2.231 . . . . 0.0 112.031 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 129.2 -2.41 6.24 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.56 2.028 . . . . 0.0 116.787 169.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -134.64 174.18 10.84 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.721 1.761 . . . . 0.0 113.742 -169.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.2 175.22 7.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.074 0.95 . . . . 0.0 112.382 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -155.17 152.79 24.27 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.506 -0.746 . . . . 0.0 114.271 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -127.21 157.75 38.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.399 2.279 . . . . 0.0 110.152 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -82.64 144.09 30.53 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.538 0.608 . . . . 0.0 112.534 172.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -131.82 115.75 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 126.375 1.87 . . . . 0.0 108.746 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.0 -86.28 0.3 Allowed Glycine 0 CA--C 1.534 1.253 0 C-N-CA 124.4 1.0 . . . . 0.0 111.708 -172.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -141.29 14.95 2.22 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.577 1.951 . . . . 0.0 112.772 169.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -125.96 140.19 52.82 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.878 -1.139 . . . . 0.0 112.276 -169.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.5 t -74.66 142.47 44.51 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.29 -0.882 . . . . 0.0 113.028 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.58 132.13 25.41 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.751 1.62 . . . . 0.0 111.163 173.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.9 m -88.45 148.54 24.14 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.762 1.225 . . . . 0.0 113.898 -169.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.4 m -142.94 146.9 39.29 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.373 1.869 . . . . 0.0 112.172 -170.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -66.8 153.25 78.58 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.046 2.498 . . . . 0.0 113.652 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 . . . . . 0 C--O 1.254 1.299 0 CA-C-O 117.933 -1.032 . . . . 0.0 111.225 169.92 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -88.17 169.06 12.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 113.199 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.5 t -68.87 126.6 30.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 113.819 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -100.96 123.7 45.55 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 166.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.56 -41.4 98.42 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -57.91 -49.04 78.1 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.022 0.929 . . . . 0.0 111.999 172.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -64.04 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.789 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -65.81 -45.12 83.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.647 1.179 . . . . 0.0 112.58 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.31 -48.93 75.69 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.928 -1.107 . . . . 0.0 111.666 173.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.0 mt -59.65 -42.49 92.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.558 0.743 . . . . 0.0 111.871 175.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.9 t -60.13 -46.83 88.31 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.16 0.584 . . . . 0.0 111.409 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.1 m -73.97 -25.94 60.2 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -60.91 -31.52 71.03 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.819 -1.176 . . . . 0.0 112.855 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -66.58 -27.85 68.05 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.044 0.937 . . . . 0.0 112.342 172.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.98 -4.11 50.25 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.786 2.034 . . . . 0.0 113.99 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.67 20.81 46.06 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.297 1.427 . . . . 0.0 116.262 173.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -148.9 174.02 12.69 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.154 1.477 . . . . 0.0 113.363 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.5 mt -74.83 168.25 20.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.979 1.312 . . . . 0.0 112.311 -177.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.86 137.07 8.86 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.452 1.025 . . . . 0.0 113.604 176.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -127.36 155.69 43.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 128.075 2.55 . . . . 0.0 111.718 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 70.7 m -94.06 127.23 39.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.792 0.437 . . . . 0.0 110.699 169.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.0 mt -143.66 127.33 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 126.532 1.933 . . . . 0.0 109.236 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.09 22.22 70.5 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 114.304 -174.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.265 27.0 mt-10 62.32 25.3 15.11 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.908 2.083 . . . . 0.0 112.6 -170.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -126.93 160.04 32.23 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.088 2.955 . . . . 0.0 110.386 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.9 t -84.24 139.43 32.37 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 112.468 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.89 130.18 31.31 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.094 1.358 . . . . 0.0 111.026 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -82.19 142.69 31.97 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.563 0.745 . . . . 0.0 110.917 175.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.6 m -139.88 146.49 47.2 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.309 1.044 . . . . 0.0 112.672 -170.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 150.9 54.46 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.329 2.686 . . . . 0.0 112.93 176.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.213 1.405 . . . . 0.0 111.036 169.214 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -107.41 163.29 13.17 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.332 1.053 . . . . 0.0 109.956 167.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -101.04 126.07 47.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.717 1.207 . . . . 0.0 111.865 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -91.55 120.97 32.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.458 0.703 . . . . 0.0 109.96 170.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 66.1 tp -67.41 -41.81 84.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.591 0.756 . . . . 0.0 112.627 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.262 0.1 OUTLIER -65.56 -38.75 90.49 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.943 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -69.57 -33.19 72.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.48 1.036 . . . . 0.0 112.628 170.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.41 -41.68 98.73 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.595 1.089 . . . . 0.0 110.789 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.36 -43.02 99.57 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.062 -1.024 . . . . 0.0 113.118 171.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.84 -37.62 87.56 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 120.462 1.483 . . . . 0.0 112.882 172.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.4 m -63.16 -48.44 78.4 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.497 1.119 . . . . 0.0 110.472 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -80.35 -26.48 38.65 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.885 1.274 . . . . 0.0 114.346 -177.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -61.86 -33.74 74.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.385 1.448 . . . . 0.0 112.485 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -66.19 -11.17 47.99 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.26 1.424 . . . . 0.0 113.815 171.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.96 -1.16 20.88 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.143 2.177 . . . . 0.0 112.288 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.96 0.21 62.13 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.838 2.161 . . . . 0.0 116.609 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.56 178.84 7.04 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.486 1.643 . . . . 0.0 114.42 -169.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 mt -78.86 161.8 26.5 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.203 -0.936 . . . . 0.0 112.778 -176.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.68 139.77 15.88 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.999 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -133.16 146.91 51.98 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.039 2.136 . . . . 0.0 109.659 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 97.4 m -84.3 134.26 34.52 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 119.38 0.991 . . . . 0.0 110.096 167.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -128.86 126.28 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.968 1.707 . . . . 0.0 107.967 177.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.34 -103.04 0.6 Allowed Glycine 0 CA--C 1.531 1.092 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -169.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -134.72 21.75 3.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.586 1.554 . . . . 0.0 113.715 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -132.95 157.16 45.85 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.284 1.433 . . . . 0.0 111.711 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -71.59 146.57 48.32 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.066 0.936 . . . . 0.0 112.018 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.17 120.28 17.71 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.656 1.982 . . . . 0.0 109.203 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -81.73 134.57 35.47 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.806 -0.559 . . . . 0.0 110.171 171.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -142.28 151.56 58.61 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 124.999 1.32 . . . . 0.0 112.488 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.8 166.69 13.35 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.34 2.693 . . . . 0.0 114.219 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.142 1.777 . . . . 0.0 112.948 177.164 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 110.692 -0.114 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -60.31 149.61 33.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 t -65.01 140.29 58.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.538 1.535 . . . . 0.0 111.801 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -90.54 116.78 28.71 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.869 -0.52 . . . . 0.0 111.504 174.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.4 -36.8 84.93 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.877 -0.514 . . . . 0.0 112.079 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -62.22 -45.02 95.2 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.301 0.5 . . . . 0.0 111.69 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -61.24 -43.43 98.88 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.951 0.796 . . . . 0.0 112.044 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.77 -44.66 89.32 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 176.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.35 -51.12 70.12 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.228 1.011 . . . . 0.0 112.635 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -60.14 -40.58 90.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.26 1.391 . . . . 0.0 112.043 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -54.51 46.32 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.464 1.106 . . . . 0.0 111.745 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.2 m -64.7 -40.1 94.8 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.187 -0.946 . . . . 0.0 112.514 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -70.32 -21.55 62.9 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.994 -1.066 . . . . 0.0 112.895 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -66.85 -27.1 67.26 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.511 1.051 . . . . 0.0 111.4 170.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -83.83 -43.14 15.68 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.667 1.187 . . . . 0.0 111.166 169.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 139.63 10.5 0.79 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 117.047 1.579 . . . . 0.0 117.047 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -129.79 170.91 13.27 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.074 1.937 . . . . 0.0 111.811 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.0 mt -71.8 163.32 28.03 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.06 0.846 . . . . 0.0 112.014 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.68 149.86 18.76 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.682 1.135 . . . . 0.0 113.862 169.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -135.84 134.35 38.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.507 2.323 . . . . 0.0 110.733 171.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 34.6 m -82.52 150.52 26.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -135.86 83.35 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 124.879 1.272 . . . . 0.0 108.157 175.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.81 -80.82 0.09 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 125.644 1.592 . . . . 0.0 113.151 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -125.22 -5.41 7.26 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.629 1.572 . . . . 0.0 113.898 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -97.2 163.01 13.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.544 1.537 . . . . 0.0 111.659 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.6 t -120.09 147.82 44.37 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.196 1.398 . . . . 0.0 111.631 174.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.18 146.95 31.96 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.768 1.627 . . . . 0.0 111.025 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -105.39 137.51 43.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.322 1.049 . . . . 0.0 111.893 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.47 153.58 76.27 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.953 1.301 . . . . 0.0 113.191 -169.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -72.16 155.43 56.62 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.949 2.433 . . . . 0.0 115.563 -176.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.105 1.762 . . . . 0.0 111.033 168.131 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 111.3 0.111 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -129.43 151.5 49.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.696 1.198 . . . . 0.0 113.268 -178.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -67.16 130.54 43.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.176 1.79 . . . . 0.0 112.699 176.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -89.16 69.11 8.28 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.146 0.978 . . . . 0.0 111.039 169.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.43 -46.22 76.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.864 0.866 . . . . 0.0 112.692 -172.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -63.66 -44.03 95.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.324 0.966 . . . . 0.0 112.236 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -59.94 -42.47 94.1 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 119.228 0.922 . . . . 0.0 111.962 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.3 t -62.84 -47.75 82.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.082 1.353 . . . . 0.0 112.304 177.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.75 -53.82 53.33 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.777 0.831 . . . . 0.0 111.824 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -58.99 -36.77 75.46 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 121.283 -0.885 . . . . 0.0 112.252 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.4 t -65.24 -50.74 64.67 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.781 1.233 . . . . 0.0 112.425 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.3 m -68.35 -37.91 80.95 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.104 0.962 . . . . 0.0 112.242 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -65.67 -22.75 66.66 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.838 -1.164 . . . . 0.0 113.659 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.7 t -65.3 -37.0 85.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.713 0.805 . . . . 0.0 111.318 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -75.56 -43.07 50.43 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.904 1.282 . . . . 0.0 111.218 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 141.33 9.27 0.67 Allowed Glycine 0 CA--C 1.539 1.533 0 N-CA-C 116.659 1.423 . . . . 0.0 116.659 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -141.55 171.58 13.86 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.448 1.624 . . . . 0.0 112.228 -174.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -77.05 167.13 22.33 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.62 0.768 . . . . 0.0 112.836 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.47 132.82 10.17 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.322 1.439 . . . . 0.0 111.164 168.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -137.77 140.0 40.38 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 119.198 1.499 . . . . 0.0 112.711 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.6 t -82.7 139.33 33.72 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.903 1.281 . . . . 0.0 113.804 -172.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.9 mt -128.41 103.28 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 126.635 1.974 . . . . 0.0 107.528 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.55 -98.24 0.74 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.592 1.091 . . . . 0.0 112.813 -175.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -128.2 3.87 5.79 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.083 2.153 . . . . 0.0 112.966 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -117.43 151.42 37.1 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.528 1.531 . . . . 0.0 110.787 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.4 t -126.29 149.38 49.17 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.158 -0.963 . . . . 0.0 112.218 -175.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 152.16 38.67 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.443 1.497 . . . . 0.0 112.434 -171.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.0 m -87.04 134.93 33.45 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.114 0.966 . . . . 0.0 113.575 -172.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 m -145.85 150.45 42.82 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.738 1.615 . . . . 0.0 113.834 -170.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.95 159.11 48.74 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.022 3.148 . . . . 0.0 114.85 -175.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.233 1.813 . . . . 0.0 111.672 169.282 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.202 0.075 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -139.97 72.72 1.4 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.533 1.533 . . . . 0.0 110.458 -175.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.7 t 57.71 72.78 0.5 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.684 1.594 . . . . 0.0 113.271 -168.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -67.2 89.97 0.2 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.08 1.352 . . . . 0.0 111.353 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -71.59 -38.76 70.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.602 1.561 . . . . 0.0 112.33 -173.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.87 -45.39 78.25 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.192 -0.942 . . . . 0.0 112.629 -178.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -59.8 -36.32 76.5 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-N 119.046 0.839 . . . . 0.0 111.621 177.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.2 t -67.57 -46.17 73.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.668 1.587 . . . . 0.0 113.28 174.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -57.66 -47.81 81.25 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.146 1.339 . . . . 0.0 112.393 175.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 45.5 mt -59.92 -41.0 90.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.282 1.033 . . . . 0.0 111.532 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.6 t -64.52 -48.1 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.688 1.195 . . . . 0.0 112.893 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.5 m -68.98 -27.51 65.78 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.082 -1.012 . . . . 0.0 112.327 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -59.19 -34.77 72.53 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.089 -1.007 . . . . 0.0 112.137 175.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 m -67.63 -18.93 65.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.411 1.084 . . . . 0.0 113.639 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.2 mt -98.54 -3.9 35.4 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.852 2.061 . . . . 0.0 112.639 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.87 57.59 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.72 1.628 . . . . 0.0 115.892 175.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -144.54 176.13 9.62 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.581 1.691 . . . . 0.0 113.578 -178.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.21 172.33 13.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.858 1.263 . . . . 0.0 112.634 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.46 122.45 2.64 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.674 1.131 . . . . 0.0 111.446 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -119.61 148.01 43.85 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.369 1.467 . . . . 0.0 112.307 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.9 t -78.72 127.42 32.05 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.061 0.545 . . . . 0.0 112.454 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -132.18 100.99 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.99 1.316 . . . . 0.0 109.057 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.27 -124.26 15.96 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 121.495 -0.753 . . . . 0.0 111.607 -172.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -88.94 -2.75 58.74 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -137.54 133.45 34.53 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.661 1.184 . . . . 0.0 113.291 -171.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.7 t -88.36 139.63 30.29 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.434 1.094 . . . . 0.0 111.729 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.31 154.46 50.07 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.941 1.296 . . . . 0.0 111.809 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.9 m -78.88 136.62 37.35 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.4 m -148.75 154.29 40.3 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.69 1.596 . . . . 0.0 113.393 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.12 164.05 36.31 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.124 3.216 . . . . 0.0 114.089 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 126.516 1.927 . . . . 0.0 112.992 -177.902 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 119.54 -0.267 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -145.27 139.68 27.28 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.451 1.501 . . . . 0.0 111.72 175.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -76.54 111.27 11.83 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 -172.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -108.94 81.83 1.51 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.844 1.658 . . . . 0.0 109.291 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.2 tp -64.98 -40.21 94.62 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.367 1.067 . . . . 0.0 112.41 -170.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -63.06 -46.33 87.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.202 175.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -61.4 -36.64 80.87 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 119.807 1.185 . . . . 0.0 112.312 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.5 -42.44 95.84 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.735 0.814 . . . . 0.0 112.633 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.33 -48.0 83.62 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.066 -1.021 . . . . 0.0 112.22 173.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 mt -62.55 -34.34 76.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.199 1.0 . . . . 0.0 112.327 177.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 t -66.93 -54.75 18.93 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.419 1.488 . . . . 0.0 112.316 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.3 m -71.67 -26.0 62.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.564 0.746 . . . . 0.0 112.944 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -54.45 -38.42 66.32 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.188 1.395 . . . . 0.0 112.411 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.7 m -74.81 -13.57 60.59 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 178.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.8 mt -92.42 -20.5 20.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.172 1.389 . . . . 0.0 111.988 169.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.28 24.23 10.5 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.154 1.359 . . . . 0.0 115.287 178.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -146.15 173.48 12.17 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 118.795 1.297 . . . . 0.0 112.913 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 mt -76.29 162.77 27.64 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.26 1.024 . . . . 0.0 112.361 -177.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -127.72 128.07 5.98 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.517 1.056 . . . . 0.0 112.815 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -123.64 159.18 29.86 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.214 2.206 . . . . 0.0 111.834 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.7 m -92.41 127.48 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.707 0.803 . . . . 0.0 110.368 168.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -132.82 112.94 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.48 36.29 90.9 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 121.532 -0.73 . . . . 0.0 112.03 -169.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.25 6.6 mp0 61.0 10.52 2.87 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -178.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -111.35 138.26 48.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.291 1.437 . . . . 0.0 110.36 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.9 t -63.39 130.37 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.809 1.244 . . . . 0.0 112.986 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.72 130.67 47.45 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.169 1.787 . . . . 0.0 110.365 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -87.95 136.48 32.95 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.945 -0.472 . . . . 0.0 111.455 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.94 145.85 52.4 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.183 1.393 . . . . 0.0 112.001 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.49 149.39 91.13 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.934 2.423 . . . . 0.0 113.422 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.325 1.05 . . . . 0.0 111.154 169.589 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -114.79 144.32 43.69 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.693 1.197 . . . . 0.0 112.593 169.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 t -74.69 122.71 23.66 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.133 1.373 . . . . 0.0 110.596 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -76.59 127.24 32.43 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.156 0.982 . . . . 0.0 110.332 172.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.31 -45.61 83.65 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.077 -176.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.1 tpp85 -63.88 -42.23 97.53 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.608 1.095 . . . . 0.0 112.736 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 25.3 ttp85 -54.77 -39.83 68.78 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.104 0.865 . . . . 0.0 111.738 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -70.5 -47.02 62.52 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.929 0.892 . . . . 0.0 112.862 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -56.86 -42.93 80.61 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.68 1.192 . . . . 0.0 112.996 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.6 mt -66.24 -33.87 76.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.749 0.704 . . . . 0.0 112.143 176.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.5 p -66.14 -31.91 73.05 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -87.38 -25.08 24.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.278 1.031 . . . . 0.0 113.335 177.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -56.45 -34.14 66.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.367 1.067 . . . . 0.0 110.973 169.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 m -60.02 -20.53 58.33 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.466 1.506 . . . . 0.0 113.404 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.1 mt -107.31 -13.21 15.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.703 1.601 . . . . 0.0 113.775 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.23 14.83 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.264 1.411 . . . . 0.0 116.237 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.91 -177.22 5.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.097 1.449 . . . . 0.0 112.842 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 mt -74.53 162.56 28.68 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.053 0.941 . . . . 0.0 112.195 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.74 147.92 18.69 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 124.432 1.015 . . . . 0.0 111.959 169.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -147.19 139.35 24.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.407 1.883 . . . . 0.0 111.221 -177.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.98 116.18 27.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.13 0.572 . . . . 0.0 110.435 176.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.7 mt -102.54 109.55 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.487 1.115 . . . . 0.0 108.407 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 -84.2 0.18 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.204 0.906 . . . . 0.0 112.625 -178.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.52 21.97 2.18 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.316 1.446 . . . . 0.0 114.108 171.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -140.56 139.75 35.04 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.908 -1.12 . . . . 0.0 112.979 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.61 139.53 51.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.091 1.356 . . . . 0.0 113.662 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.11 48.39 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.473 1.909 . . . . 0.0 110.332 169.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -102.37 103.08 13.48 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.273 0.629 . . . . 0.0 111.141 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 m -90.21 147.52 37.13 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 123.74 0.816 . . . . 0.0 112.153 -176.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -68.57 163.96 34.83 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.838 2.358 . . . . 0.0 112.982 170.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 C--O 1.254 1.334 0 CA-C-O 117.305 -1.331 . . . . 0.0 113.19 173.855 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 120.588 0.232 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.15 145.85 47.82 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 112.002 -171.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -63.41 129.34 39.84 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.44 1.496 . . . . 0.0 111.4 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -87.27 113.64 23.18 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.65 0.78 . . . . 0.0 109.848 170.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.04 -41.35 78.5 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.408 1.083 . . . . 0.0 112.641 -176.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.4 mmp_? -58.68 -51.49 69.71 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.169 0.895 . . . . 0.0 112.053 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpm_? -61.48 -38.4 87.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.248 0.619 . . . . 0.0 111.415 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.5 t -63.82 -46.55 84.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.259 1.024 . . . . 0.0 113.084 173.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -57.47 -45.44 84.8 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.566 1.076 . . . . 0.0 112.503 175.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.0 mt -70.58 -33.33 70.98 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.939 0.895 . . . . 0.0 111.922 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 t -65.98 -46.01 79.59 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.581 0.352 . . . . 0.0 111.604 171.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.23 -26.46 68.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.735 -1.228 . . . . 0.0 112.955 175.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -60.33 -30.24 69.39 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.822 -1.174 . . . . 0.0 112.224 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.2 m -68.35 -15.28 63.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 171.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.6 mt -105.15 -10.02 17.39 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.964 1.706 . . . . 0.0 112.893 174.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.71 7.2 39.59 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.726 2.108 . . . . 0.0 116.59 174.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.11 179.71 7.04 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.218 2.009 . . . . 0.0 114.347 -170.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.46 168.54 18.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.943 1.297 . . . . 0.0 112.497 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.57 148.79 19.64 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 124.629 1.109 . . . . 0.0 113.567 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -133.11 151.15 52.02 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.869 2.467 . . . . 0.0 110.772 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 93.2 m -99.31 141.77 31.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.108 0.956 . . . . 0.0 113.395 175.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.9 mt -126.31 172.01 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 C-N-CA 129.64 3.176 . . . . 0.0 106.96 173.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.33 102.81 0.09 OUTLIER Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.409 -1.432 . . . . 0.0 113.842 178.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 51.69 35.4 14.95 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 114.444 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -148.36 134.45 19.26 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.554 1.141 . . . . 0.0 112.299 -177.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.5 t -96.32 134.83 38.97 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.283 1.433 . . . . 0.0 110.408 169.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.33 131.48 43.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.009 1.324 . . . . 0.0 111.898 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -91.44 142.55 27.55 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.909 0.884 . . . . 0.0 111.956 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.25 151.0 57.25 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 125.656 1.582 . . . . 0.0 112.334 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.66 160.8 47.15 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.143 2.562 . . . . 0.0 112.984 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.176 1.39 . . . . 0.0 112.649 175.89 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.6 m . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.01 68.67 8.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.536 -0.728 . . . . 0.0 110.1 166.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.9 tp -50.54 -32.21 17.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.63 1.572 . . . . 0.0 113.379 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -59.01 -54.26 49.15 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.931 0.892 . . . . 0.0 112.191 171.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -67.61 -28.68 67.95 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.152 0.887 . . . . 0.0 112.471 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.6 m -66.31 -46.47 76.8 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 124.691 1.197 . . . . 0.0 112.163 170.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.97 -43.1 86.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.36 -0.829 . . . . 0.0 112.346 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.65 -50.52 72.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.118 0.872 . . . . 0.0 111.828 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.7 m -62.73 -41.31 99.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.495 0.718 . . . . 0.0 112.212 -176.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.0 m -77.8 -21.66 51.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 176.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -59.68 -36.04 75.68 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 120.074 1.307 . . . . 0.0 111.842 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -61.9 -24.85 67.2 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.1 mt -93.93 -4.47 49.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.814 1.646 . . . . 0.0 112.765 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.35 14.32 60.36 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.086 1.803 . . . . 0.0 116.333 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.23 178.8 8.65 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 119.872 1.836 . . . . 0.0 114.595 -172.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.9 mt -72.09 168.91 17.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.524 1.53 . . . . 0.0 112.144 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.84 59.97 0.64 Allowed Glycine 0 N--CA 1.474 1.197 0 C-N-CA 126.306 1.908 . . . . 0.0 113.868 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -66.06 148.67 51.46 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.57 1.948 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.4 t -86.35 120.09 27.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.727 0.811 . . . . 0.0 111.709 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -131.8 112.71 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.079 1.352 . . . . 0.0 109.509 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.45 39.54 97.83 Favored Glycine 0 CA--C 1.535 1.288 0 O-C-N 121.426 -0.796 . . . . 0.0 112.659 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.61 22.13 12.57 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.052 1.741 . . . . 0.0 115.352 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -139.33 149.15 43.87 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.123 1.769 . . . . 0.0 110.296 167.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.4 m -79.45 156.97 27.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -150.72 138.43 19.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.921 1.689 . . . . 0.0 110.599 171.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.8 m -82.6 129.99 35.04 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 111.745 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.4 m -148.97 155.79 40.53 Favored Pre-proline 0 N--CA 1.484 1.244 0 C-N-CA 125.859 1.664 . . . . 0.0 113.472 -173.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -67.43 163.2 35.64 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.888 3.059 . . . . 0.0 115.231 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 127.243 2.217 . . . . 0.0 114.321 177.08 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 CA--C 1.552 1.048 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -92.68 87.51 5.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.743 1.617 . . . . 0.0 108.896 168.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.8 tp -67.42 -38.68 84.97 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.755 0.822 . . . . 0.0 112.804 -170.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -65.23 -42.74 93.09 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.655 1.116 . . . . 0.0 112.333 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -55.3 -41.92 72.99 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.369 0.986 . . . . 0.0 111.845 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -64.57 -50.07 68.7 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.372 0.669 . . . . 0.0 111.531 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.02 -42.05 93.48 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.745 -1.222 . . . . 0.0 113.725 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.83 -48.97 72.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.639 1.109 . . . . 0.0 111.775 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 79.1 p -67.35 -32.57 73.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.07 -29.13 62.73 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.491 1.041 . . . . 0.0 113.359 170.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.87 -38.74 89.44 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.848 -1.158 . . . . 0.0 111.424 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -56.05 -33.2 64.77 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.659 0.783 . . . . 0.0 112.266 173.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.5 mt -84.71 -13.34 51.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.166 1.387 . . . . 0.0 112.751 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.83 23.18 13.99 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.577 -1.124 . . . . 0.0 115.829 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -155.31 176.12 12.99 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.01 1.405 . . . . 0.0 113.433 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.82 169.74 17.76 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.301 1.441 . . . . 0.0 113.436 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.89 134.52 9.93 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 110.618 167.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -125.04 136.99 54.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.756 1.622 . . . . 0.0 113.384 172.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.53 127.36 32.44 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.896 1.678 . . . . 0.0 110.376 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -87.71 -31.34 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.119 1.368 . . . . 0.0 111.831 176.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.93 -102.54 0.19 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 128.114 2.768 . . . . 0.0 110.988 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -74.83 -21.98 58.96 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.801 -0.823 . . . . 0.0 112.698 171.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.59 167.52 11.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.6 1.96 . . . . 0.0 110.918 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 152.49 47.81 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.257 1.423 . . . . 0.0 111.284 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.29 154.99 43.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.3 m -79.48 137.59 37.27 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -149.59 156.29 38.97 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 126.078 1.751 . . . . 0.0 112.302 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -62.69 168.65 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.93 3.087 . . . . 0.0 115.23 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.249 1.054 0 C-N-CA 126.664 1.986 . . . . 0.0 112.342 174.049 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.2 t . . . . . 0 CA--C 1.541 0.628 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -74.85 69.8 1.88 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.536 1.135 . . . . 0.0 112.341 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.13 -45.23 75.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.709 1.603 . . . . 0.0 112.568 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -61.21 -47.23 87.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.387 0.675 . . . . 0.0 112.129 178.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 -58.79 -40.71 84.81 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.375 0.67 . . . . 0.0 111.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.06 -50.29 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.61 1.164 . . . . 0.0 112.691 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -59.81 -38.14 81.14 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.633 -1.292 . . . . 0.0 113.2 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.36 -34.59 78.5 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.032 0.833 . . . . 0.0 112.395 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.1 t -65.55 -45.55 82.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.459 0.304 . . . . 0.0 111.7 170.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.4 m -70.19 -28.38 65.26 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mtp180 -58.62 -32.49 69.07 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.663 1.185 . . . . 0.0 113.161 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -78.3 0.51 25.12 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 175.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.4 mt -123.83 -3.19 8.21 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 127.147 2.179 . . . . 0.0 113.577 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 13.67 58.92 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.62 1.581 . . . . 0.0 116.969 173.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -145.72 -179.58 6.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.826 1.813 . . . . 0.0 114.54 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 69.0 mt -83.08 169.87 15.42 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.385 1.474 . . . . 0.0 112.825 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.89 129.41 6.56 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.01 1.291 . . . . 0.0 112.038 169.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -124.04 141.81 51.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.962 1.305 . . . . 0.0 113.5 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 99.4 m -81.73 146.06 30.17 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.448 1.499 . . . . 0.0 112.505 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -103.74 -26.61 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-O 123.466 1.603 . . . . 0.0 112.804 -177.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.34 -48.92 0.21 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 128.08 2.752 . . . . 0.0 111.832 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -139.18 -18.55 1.0 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 169.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -101.53 166.94 10.45 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.589 1.555 . . . . 0.0 110.614 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.5 t -136.17 160.31 39.05 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.986 1.314 . . . . 0.0 112.673 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.29 150.28 35.45 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.341 1.456 . . . . 0.0 112.181 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.7 m -81.03 136.31 35.96 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -149.72 154.05 37.16 Favored Pre-proline 0 N--CA 1.481 1.086 0 C-N-CA 126.108 1.763 . . . . 0.0 113.256 -169.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.93 164.1 36.5 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.284 3.323 . . . . 0.0 113.949 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 C--O 1.258 1.502 0 C-N-CA 126.232 1.813 . . . . 0.0 113.946 -177.053 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.3 m . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.36 73.17 7.25 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 166.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.7 tp -57.95 -38.63 76.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -167.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -58.98 -52.48 65.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.259 0.936 . . . . 0.0 110.996 172.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -57.1 -42.54 80.96 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 118.913 0.779 . . . . 0.0 112.79 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 89.4 m -63.62 -38.7 92.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.258 1.023 . . . . 0.0 112.691 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -62.43 -46.99 86.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.121 -0.987 . . . . 0.0 112.564 171.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 77.0 mt -58.5 -44.25 89.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.111 0.869 . . . . 0.0 111.06 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.9 m -57.22 -54.52 45.85 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.123 0.969 . . . . 0.0 112.234 174.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.3 m -63.16 -37.61 87.9 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.46 1.027 . . . . 0.0 112.794 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -63.81 -23.8 67.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.599 -1.313 . . . . 0.0 113.745 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 p -66.95 -28.0 67.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 169.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.8 mt -91.13 -5.29 55.28 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.945 2.098 . . . . 0.0 112.757 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.02 55.27 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 126.251 1.881 . . . . 0.0 116.741 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -132.07 177.88 7.22 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.918 1.859 . . . . 0.0 113.971 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.0 mt -78.8 163.69 25.14 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.565 1.146 . . . . 0.0 113.748 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.2 127.07 6.49 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 125.113 1.339 . . . . 0.0 113.076 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -130.87 153.31 49.27 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.141 1.776 . . . . 0.0 111.755 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.2 t -82.48 137.1 34.74 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.897 0.879 . . . . 0.0 111.0 170.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 35.1 mt -130.65 91.95 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.681 1.192 . . . . 0.0 108.714 174.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.97 55.71 25.03 Favored Glycine 0 CA--C 1.529 0.964 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.629 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 64.26 2.79 1.59 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.467 2.307 . . . . 0.0 116.421 -175.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -118.14 118.65 32.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.168 1.387 . . . . 0.0 111.733 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.7 m -62.57 146.11 52.71 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 159.5 43.28 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.305 1.842 . . . . 0.0 111.624 174.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.7 m -100.81 141.11 34.15 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.026 0.93 . . . . 0.0 112.319 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.97 146.53 52.72 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.791 1.236 . . . . 0.0 112.034 -175.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -78.84 162.25 26.8 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.897 2.398 . . . . 0.0 112.073 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.257 1.458 0 C-N-CA 126.061 1.744 . . . . 0.0 114.364 178.601 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 CA--C 1.542 0.653 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -89.58 76.01 7.42 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.114 0.965 . . . . 0.0 110.066 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.62 -40.75 72.55 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.829 1.252 . . . . 0.0 112.834 -172.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -62.83 -46.99 85.33 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.383 0.992 . . . . 0.0 111.93 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -63.2 -38.39 90.97 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.232 -0.917 . . . . 0.0 111.726 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -61.1 -44.31 97.55 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.989 0.915 . . . . 0.0 112.349 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.35 -41.4 93.58 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.212 1.005 . . . . 0.0 112.618 174.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -65.66 -42.41 91.38 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.948 1.249 . . . . 0.0 111.909 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.0 t -60.52 -32.91 71.92 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.865 0.866 . . . . 0.0 112.315 175.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -81.37 -37.55 28.03 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.137 0.975 . . . . 0.0 113.1 171.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.8 tpp180 -64.13 -28.0 69.47 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 119.986 -1.697 . . . . 0.0 111.889 175.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -60.2 -22.08 62.52 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.406 1.482 . . . . 0.0 112.087 169.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -108.63 1.32 21.22 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 127.968 2.507 . . . . 0.0 113.296 174.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.82 14.06 63.66 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.837 1.684 . . . . 0.0 116.888 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -138.2 175.27 9.72 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.681 2.241 . . . . 0.0 114.6 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.1 mt -81.39 168.87 17.89 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.341 1.056 . . . . 0.0 112.015 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -129.29 140.73 11.94 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 124.918 1.247 . . . . 0.0 112.491 173.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -133.27 141.07 47.82 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.951 1.7 . . . . 0.0 111.534 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.9 t -72.37 155.39 40.2 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.677 1.591 . . . . 0.0 113.032 -176.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.9 mt -110.37 -28.0 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 125.975 1.71 . . . . 0.0 112.499 172.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 158.9 -75.19 0.2 Allowed Glycine 0 CA--C 1.53 0.987 0 C-N-CA 127.385 2.421 . . . . 0.0 111.726 174.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -94.18 -28.93 15.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.063 0.945 . . . . 0.0 112.51 169.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -106.33 177.9 4.72 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.158 1.383 . . . . 0.0 111.973 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -144.6 160.87 40.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.675 1.59 . . . . 0.0 111.561 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.39 154.73 35.05 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.975 0.91 . . . . 0.0 113.007 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.59 152.48 39.26 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.799 1.24 . . . . 0.0 113.982 -175.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -144.47 151.7 51.44 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.188 1.795 . . . . 0.0 113.006 -176.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -71.25 162.04 43.78 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.48 2.786 . . . . 0.0 112.8 170.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.486 1.514 . . . . 0.0 113.39 175.357 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.1 t . . . . . 0 CA--C 1.547 0.838 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -75.37 103.59 5.58 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.942 0.792 . . . . 0.0 110.376 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.72 -40.72 95.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.581 0.753 . . . . 0.0 111.993 -177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -43.15 91.34 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.061 0.846 . . . . 0.0 112.396 -175.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -59.82 -35.39 74.61 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.893 1.224 . . . . 0.0 111.346 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.87 -37.46 58.9 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 125.071 1.348 . . . . 0.0 113.804 176.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -58.65 -48.52 80.75 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.645 1.111 . . . . 0.0 111.268 171.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 49.0 mt -61.97 -41.35 97.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.405 1.002 . . . . 0.0 111.732 176.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 64.2 m -61.7 -39.32 91.08 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.418 0.687 . . . . 0.0 112.723 176.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.3 m -80.75 -38.72 28.18 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.163 0.892 . . . . 0.0 113.025 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.7 mmm-85 -63.54 -22.76 67.07 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.363 -1.461 . . . . 0.0 113.48 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.79 -35.27 76.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.373 0.669 . . . . 0.0 111.376 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.0 mt -86.94 -34.27 19.39 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.835 1.654 . . . . 0.0 112.176 175.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 137.53 -5.53 3.48 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 125.494 1.521 . . . . 0.0 116.236 170.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -126.93 174.39 8.87 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.366 1.583 . . . . 0.0 113.556 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 mt -72.58 162.06 29.97 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.976 0.893 . . . . 0.0 112.764 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.04 131.12 7.38 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.859 1.219 . . . . 0.0 111.253 172.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.3 142.36 50.56 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.994 1.718 . . . . 0.0 112.188 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 56.2 m -83.67 82.44 8.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.22 1.408 . . . . 0.0 111.133 170.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.03 115.46 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 O-C-N 121.447 -0.783 . . . . 0.0 109.398 -175.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.7 50.47 63.17 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 122.114 -0.367 . . . . 0.0 112.494 -176.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 55.75 26.95 10.06 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.06 144.1 27.66 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.733 -1.229 . . . . 0.0 112.301 170.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.6 m -77.17 137.82 39.1 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -170.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.46 137.75 44.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.61 1.564 . . . . 0.0 110.465 169.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -81.59 137.24 35.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.974 -0.454 . . . . 0.0 110.709 171.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -142.02 148.26 47.92 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 125.19 1.396 . . . . 0.0 111.854 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.3 164.66 33.24 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.12 2.547 . . . . 0.0 112.362 174.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.573 1.549 . . . . 0.0 112.776 -179.224 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.0 m . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -89.74 72.54 7.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.19 1.396 . . . . 0.0 109.944 169.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.29 -33.36 70.98 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -168.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -62.82 -51.65 66.23 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.504 1.047 . . . . 0.0 111.561 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -57.39 -41.74 80.83 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.162 0.892 . . . . 0.0 110.984 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.93 -46.37 81.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 124.87 1.268 . . . . 0.0 113.715 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.91 -49.69 75.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.099 0.863 . . . . 0.0 112.243 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.91 -38.09 89.82 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.159 0.891 . . . . 0.0 111.754 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -59.74 -52.75 64.17 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.492 0.717 . . . . 0.0 111.645 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.8 m -63.34 -35.35 80.09 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.189 0.904 . . . . 0.0 111.863 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -65.03 -26.15 68.14 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.385 -1.447 . . . . 0.0 113.053 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.6 p -63.96 -18.97 64.79 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.208 0.913 . . . . 0.0 112.848 169.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -107.35 -5.81 17.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.649 2.38 . . . . 0.0 113.599 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.93 16.38 30.87 Favored Glycine 0 CA--C 1.541 1.677 0 N-CA-C 117.235 1.654 . . . . 0.0 117.235 173.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -144.65 169.85 17.21 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.577 1.688 . . . . 0.0 112.868 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.1 mt -77.21 165.86 23.98 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.998 -1.064 . . . . 0.0 113.167 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.93 140.82 13.94 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.997 1.284 . . . . 0.0 111.492 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -140.47 158.67 43.66 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.579 1.952 . . . . 0.0 112.142 176.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -90.6 132.28 35.83 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.31 1.044 . . . . 0.0 112.86 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.7 mt -121.74 103.21 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.625 1.57 . . . . 0.0 108.321 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.1 48.7 81.28 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 123.896 0.76 . . . . 0.0 113.966 176.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.276 79.5 mt-10 64.44 27.3 13.56 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -175.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -146.49 143.07 28.69 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.372 -1.455 . . . . 0.0 110.792 166.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.3 m -84.66 145.36 28.02 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 -169.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.07 146.98 52.41 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.237 2.215 . . . . 0.0 111.656 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.8 m -92.0 138.53 31.46 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.51 0.724 . . . . 0.0 111.23 175.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 m -147.53 153.39 43.55 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 111.34 -169.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.8 155.71 48.73 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.942 2.428 . . . . 0.0 113.408 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.415 1.486 . . . . 0.0 113.127 169.796 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.548 0.866 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -75.59 68.25 2.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.233 1.013 . . . . 0.0 111.209 167.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 tp -49.97 -49.59 49.8 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.452 1.501 . . . . 0.0 112.958 -174.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -61.84 -38.77 89.44 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.195 0.907 . . . . 0.0 112.799 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -65.85 -38.11 87.99 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.793 -0.567 . . . . 0.0 111.895 175.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.5 m -75.43 -30.9 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.737 1.215 . . . . 0.0 113.818 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.71 -43.75 80.9 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.51 1.05 . . . . 0.0 110.916 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.3 mt -64.53 -43.71 93.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.235 1.014 . . . . 0.0 112.014 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 m -60.83 -37.88 83.54 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.78 -25.61 61.23 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.198 -0.939 . . . . 0.0 112.81 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -60.06 -39.19 85.17 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.742 -1.224 . . . . 0.0 110.903 171.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -58.68 -23.26 59.08 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.749 0.82 . . . . 0.0 112.967 173.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.48 -8.4 23.19 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.763 1.625 . . . . 0.0 113.922 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.51 33.78 13.02 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.32 1.438 . . . . 0.0 115.205 175.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.37 -178.24 7.12 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.969 1.308 . . . . 0.0 112.621 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.2 mt -85.0 168.23 15.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.596 1.158 . . . . 0.0 112.953 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.71 146.59 17.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.692 1.139 . . . . 0.0 115.056 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -138.32 163.34 32.07 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 128.146 2.578 . . . . 0.0 111.942 173.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.76 154.39 22.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 172.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mt -136.49 91.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 127.915 2.486 . . . . 0.0 105.581 166.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.8 -128.09 31.59 Favored Glycine 0 CA--C 1.536 1.352 0 O-C-N 121.456 -0.778 . . . . 0.0 111.158 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.2 mp0 -84.97 -4.99 59.35 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.974 1.31 . . . . 0.0 114.339 171.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -100.59 177.47 5.0 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.168 1.787 . . . . 0.0 112.524 175.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.3 m -121.82 161.86 21.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.915 1.286 . . . . 0.0 113.479 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.74 154.58 36.57 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.049 1.739 . . . . 0.0 111.031 169.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 54.5 m -95.28 148.69 22.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.418 0.687 . . . . 0.0 112.676 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -141.95 151.96 60.74 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 126.176 1.79 . . . . 0.0 112.411 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.23 158.42 57.73 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.993 2.462 . . . . 0.0 113.868 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.458 1.903 . . . . 0.0 112.906 176.243 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.8 t . . . . . 0 CA--C 1.544 0.735 0 CA-C-O 119.726 -0.178 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -90.81 120.16 31.62 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.778 -1.201 . . . . 0.0 110.984 174.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -74.09 -48.95 26.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.482 0.713 . . . . 0.0 112.696 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.7 ttp180 -62.74 -43.4 98.89 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.198 -0.939 . . . . 0.0 112.354 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -59.27 -37.7 78.28 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.867 0.758 . . . . 0.0 111.099 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -72.43 -36.83 68.68 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.12 1.368 . . . . 0.0 114.395 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -58.56 -47.44 84.24 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.701 1.592 . . . . 0.0 111.733 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -65.55 -36.32 83.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.17 . . . . 0.0 112.5 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -49.18 68.85 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.965 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.5 m -65.84 -23.32 66.65 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.191 -0.943 . . . . 0.0 112.772 175.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -62.33 -31.65 72.3 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.656 -1.277 . . . . 0.0 113.195 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.7 m -67.97 -26.36 65.89 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 169.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.4 mt -85.68 -7.07 59.02 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.244 1.017 . . . . 0.0 112.614 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.29 21.06 39.47 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.842 1.687 . . . . 0.0 115.575 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -149.89 -179.71 7.35 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 119.695 1.748 . . . . 0.0 113.598 -177.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.8 mt -81.37 170.65 15.73 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.161 1.384 . . . . 0.0 112.09 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.49 141.92 12.81 Favored Glycine 0 N--CA 1.472 1.06 0 C-N-CA 124.647 1.117 . . . . 0.0 113.547 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -129.19 151.34 49.96 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 127.007 2.123 . . . . 0.0 111.912 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 m -97.05 135.34 39.18 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.851 1.26 . . . . 0.0 110.672 169.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.6 mt -136.53 110.81 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.788 0.835 . . . . 0.0 109.219 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.84 -127.22 43.84 Favored Glycine 0 CA--C 1.532 1.149 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -83.33 -2.33 55.47 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -152.52 155.83 38.2 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 120.886 1.675 . . . . 0.0 115.355 -170.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -88.08 160.87 17.63 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -142.81 145.17 32.95 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.353 1.861 . . . . 0.0 111.55 168.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.5 m -91.46 143.59 26.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.718 0.807 . . . . 0.0 112.026 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.6 m -141.63 149.5 54.0 Favored Pre-proline 0 N--CA 1.48 1.059 0 C-N-CA 125.266 1.426 . . . . 0.0 112.744 -168.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.24 156.07 65.79 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.417 2.745 . . . . 0.0 113.407 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.256 1.422 . . . . 0.0 111.846 171.487 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 CA--C 1.541 0.609 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -99.73 114.3 27.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.295 1.038 . . . . 0.0 110.193 169.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -58.46 -42.64 87.91 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 tpp85 -61.42 -41.57 97.37 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.742 0.701 . . . . 0.0 112.624 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -60.26 -38.7 84.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.235 0.925 . . . . 0.0 111.454 175.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.9 m -68.78 -37.8 79.57 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.939 0.896 . . . . 0.0 112.634 174.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -59.15 -45.4 91.07 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.381 1.446 . . . . 0.0 112.911 171.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.4 mt -69.63 -31.02 68.88 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.793 0.837 . . . . 0.0 112.453 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 -39.85 82.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.695 0.798 . . . . 0.0 112.344 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.5 m -71.21 -22.03 62.06 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.348 -0.845 . . . . 0.0 112.459 170.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -64.61 -30.77 71.79 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.508 -1.37 . . . . 0.0 112.225 174.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.7 m -65.69 -9.36 26.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.563 1.145 . . . . 0.0 113.473 168.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.3 mt -119.36 -6.81 10.29 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.184 2.193 . . . . 0.0 112.939 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.52 29.47 24.29 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.058 1.313 . . . . 0.0 116.039 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.87 -179.94 7.9 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.276 1.538 . . . . 0.0 113.55 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.04 176.72 7.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.03 1.732 . . . . 0.0 111.826 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.73 151.01 22.42 Favored Glycine 0 CA--C 1.533 1.164 0 N-CA-C 116.245 1.258 . . . . 0.0 116.245 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -120.83 164.93 15.88 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.478 2.311 . . . . 0.0 112.014 -177.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.1 t -123.24 129.97 52.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.001 1.72 . . . . 0.0 112.377 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -127.26 95.32 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 127.302 2.241 . . . . 0.0 108.019 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.1 -85.93 0.06 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.042 1.306 . . . . 0.0 113.604 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -125.91 0.11 7.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.262 1.825 . . . . 0.0 114.358 -177.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -132.19 171.43 13.67 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.41 1.884 . . . . 0.0 111.023 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 59.5 m -132.79 167.79 19.53 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -172.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.65 125.89 14.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.6 m -74.51 143.77 44.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.487 0.715 . . . . 0.0 111.712 171.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.33 150.15 54.01 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 127.204 2.201 . . . . 0.0 111.19 -172.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -73.88 166.52 29.49 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.475 2.783 . . . . 0.0 113.652 -177.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 C--O 1.245 0.838 0 C-N-CA 124.438 1.095 . . . . 0.0 110.345 167.835 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.3 m . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.78 77.28 7.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.505 1.122 . . . . 0.0 108.046 167.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -43.11 54.32 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.497 1.519 . . . . 0.0 114.491 -167.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.84 -47.08 84.93 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.414 1.006 . . . . 0.0 111.975 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.24 -33.44 76.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.439 1.095 . . . . 0.0 111.434 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.29 -48.27 68.15 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.919 0.888 . . . . 0.0 112.786 170.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -61.53 -43.93 97.97 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.935 -1.103 . . . . 0.0 112.843 177.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.35 -37.69 88.41 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.548 1.067 . . . . 0.0 112.48 176.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 t -63.11 -49.67 73.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.821 0.848 . . . . 0.0 111.885 173.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.3 m -67.44 -42.87 82.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.471 -0.768 . . . . 0.0 111.904 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtp85 -64.07 -20.16 65.74 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.294 -1.504 . . . . 0.0 113.886 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 t -64.72 -31.29 72.44 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.608 0.64 . . . . 0.0 111.881 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -88.98 -16.94 30.51 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.911 1.684 . . . . 0.0 112.727 170.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.4 39.97 5.21 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.828 1.68 . . . . 0.0 115.097 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -147.63 171.62 15.33 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 118.846 1.323 . . . . 0.0 112.046 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.09 165.14 24.99 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.549 1.14 . . . . 0.0 113.251 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -119.97 136.53 11.73 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.242 1.401 . . . . 0.0 112.005 168.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -132.26 143.07 49.65 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.158 1.783 . . . . 0.0 112.024 175.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -81.57 130.62 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.093 0.957 . . . . 0.0 111.586 173.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 23' ' ' GLY . 3.3 mt -93.38 -136.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.198 1.399 . . . . 0.0 107.927 171.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.405 ' H ' HG22 ' A' ' 22' ' ' ILE . . . -76.57 81.75 1.09 Allowed Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.68 1.61 . . . . 0.0 112.227 170.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 57.41 31.36 20.08 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.672 1.989 . . . . 0.0 114.245 177.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -152.27 139.93 19.81 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.988 2.115 . . . . 0.0 109.181 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.7 t -96.49 153.62 17.74 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.04 157.12 42.43 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.559 1.144 . . . . 0.0 112.927 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.8 m -88.74 139.91 29.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -147.03 151.36 41.15 Favored Pre-proline 0 N--CA 1.484 1.253 0 C-N-CA 126.969 2.108 . . . . 0.0 112.725 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.22 160.98 47.7 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.781 2.987 . . . . 0.0 114.152 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.78 1.632 . . . . 0.0 112.372 175.194 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.1 p . . . . . 0 CA--C 1.548 0.904 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -53.29 128.25 27.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.308 1.843 . . . . 0.0 113.153 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.62 -41.44 99.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.946 1.298 . . . . 0.0 111.935 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -62.07 -49.63 75.18 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.213 0.915 . . . . 0.0 111.25 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -59.15 -42.07 89.82 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.629 0.65 . . . . 0.0 111.205 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -65.19 -43.18 92.46 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -57.62 -52.7 64.37 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.304 -0.873 . . . . 0.0 111.431 174.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.78 -37.88 85.98 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 118.985 0.811 . . . . 0.0 112.001 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.06 -42.26 99.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.157 0.983 . . . . 0.0 112.301 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.7 m -75.69 -33.39 60.36 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 121.328 -0.858 . . . . 0.0 112.99 175.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -66.5 -16.93 64.51 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 120.252 -1.53 . . . . 0.0 113.408 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.7 t -66.21 -22.92 66.36 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.733 1.213 . . . . 0.0 112.437 167.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -98.66 -26.19 14.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.277 2.231 . . . . 0.0 112.031 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 129.2 -2.41 6.24 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.56 2.028 . . . . 0.0 116.787 169.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -134.64 174.18 10.84 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.721 1.761 . . . . 0.0 113.742 -169.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.2 175.22 7.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.074 0.95 . . . . 0.0 112.382 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -155.17 152.79 24.27 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.506 -0.746 . . . . 0.0 114.271 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -127.21 157.75 38.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.399 2.279 . . . . 0.0 110.152 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -82.64 144.09 30.53 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.538 0.608 . . . . 0.0 112.534 172.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -131.82 115.75 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 126.375 1.87 . . . . 0.0 108.746 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.0 -86.28 0.3 Allowed Glycine 0 CA--C 1.534 1.253 0 C-N-CA 124.4 1.0 . . . . 0.0 111.708 -172.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -141.29 14.95 2.22 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.577 1.951 . . . . 0.0 112.772 169.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -125.96 140.19 52.82 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.878 -1.139 . . . . 0.0 112.276 -169.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.5 t -74.66 142.47 44.51 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.29 -0.882 . . . . 0.0 113.028 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.58 132.13 25.41 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.751 1.62 . . . . 0.0 111.163 173.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.9 m -88.45 148.54 24.14 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.762 1.225 . . . . 0.0 113.898 -169.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.4 m -142.94 146.9 39.29 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.373 1.869 . . . . 0.0 112.172 -170.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -66.8 153.25 78.58 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.046 2.498 . . . . 0.0 113.652 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 . . . . . 0 C--O 1.254 1.299 0 CA-C-O 117.933 -1.032 . . . . 0.0 111.225 169.92 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.5 t . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -100.96 123.7 45.55 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 166.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.56 -41.4 98.42 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -57.91 -49.04 78.1 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.022 0.929 . . . . 0.0 111.999 172.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -64.04 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.789 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -65.81 -45.12 83.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.647 1.179 . . . . 0.0 112.58 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.31 -48.93 75.69 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.928 -1.107 . . . . 0.0 111.666 173.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.0 mt -59.65 -42.49 92.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.558 0.743 . . . . 0.0 111.871 175.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.9 t -60.13 -46.83 88.31 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.16 0.584 . . . . 0.0 111.409 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.1 m -73.97 -25.94 60.2 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -60.91 -31.52 71.03 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.819 -1.176 . . . . 0.0 112.855 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -66.58 -27.85 68.05 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.044 0.937 . . . . 0.0 112.342 172.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.98 -4.11 50.25 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.786 2.034 . . . . 0.0 113.99 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.67 20.81 46.06 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.297 1.427 . . . . 0.0 116.262 173.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -148.9 174.02 12.69 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.154 1.477 . . . . 0.0 113.363 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.5 mt -74.83 168.25 20.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.979 1.312 . . . . 0.0 112.311 -177.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.86 137.07 8.86 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.452 1.025 . . . . 0.0 113.604 176.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -127.36 155.69 43.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 128.075 2.55 . . . . 0.0 111.718 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 70.7 m -94.06 127.23 39.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.792 0.437 . . . . 0.0 110.699 169.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.0 mt -143.66 127.33 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 126.532 1.933 . . . . 0.0 109.236 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.09 22.22 70.5 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 114.304 -174.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.265 27.0 mt-10 62.32 25.3 15.11 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.908 2.083 . . . . 0.0 112.6 -170.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -126.93 160.04 32.23 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.088 2.955 . . . . 0.0 110.386 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.9 t -84.24 139.43 32.37 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 112.468 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.89 130.18 31.31 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.094 1.358 . . . . 0.0 111.026 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -82.19 142.69 31.97 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.563 0.745 . . . . 0.0 110.917 175.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.6 m -139.88 146.49 47.2 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.309 1.044 . . . . 0.0 112.672 -170.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 150.9 54.46 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.329 2.686 . . . . 0.0 112.93 176.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.213 1.405 . . . . 0.0 111.036 169.214 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -91.55 120.97 32.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.458 0.703 . . . . 0.0 109.96 170.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 66.1 tp -67.41 -41.81 84.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.591 0.756 . . . . 0.0 112.627 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.262 0.1 OUTLIER -65.56 -38.75 90.49 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.943 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -69.57 -33.19 72.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.48 1.036 . . . . 0.0 112.628 170.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.41 -41.68 98.73 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.595 1.089 . . . . 0.0 110.789 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.36 -43.02 99.57 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.062 -1.024 . . . . 0.0 113.118 171.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.84 -37.62 87.56 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 120.462 1.483 . . . . 0.0 112.882 172.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.4 m -63.16 -48.44 78.4 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.497 1.119 . . . . 0.0 110.472 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -80.35 -26.48 38.65 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.885 1.274 . . . . 0.0 114.346 -177.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -61.86 -33.74 74.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.385 1.448 . . . . 0.0 112.485 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -66.19 -11.17 47.99 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.26 1.424 . . . . 0.0 113.815 171.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.96 -1.16 20.88 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.143 2.177 . . . . 0.0 112.288 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.96 0.21 62.13 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.838 2.161 . . . . 0.0 116.609 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.56 178.84 7.04 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.486 1.643 . . . . 0.0 114.42 -169.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 mt -78.86 161.8 26.5 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.203 -0.936 . . . . 0.0 112.778 -176.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.68 139.77 15.88 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.999 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -133.16 146.91 51.98 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.039 2.136 . . . . 0.0 109.659 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 97.4 m -84.3 134.26 34.52 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 119.38 0.991 . . . . 0.0 110.096 167.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -128.86 126.28 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.968 1.707 . . . . 0.0 107.967 177.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.34 -103.04 0.6 Allowed Glycine 0 CA--C 1.531 1.092 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -169.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -134.72 21.75 3.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.586 1.554 . . . . 0.0 113.715 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -132.95 157.16 45.85 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.284 1.433 . . . . 0.0 111.711 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -71.59 146.57 48.32 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.066 0.936 . . . . 0.0 112.018 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.17 120.28 17.71 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.656 1.982 . . . . 0.0 109.203 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -81.73 134.57 35.47 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.806 -0.559 . . . . 0.0 110.171 171.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -142.28 151.56 58.61 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 124.999 1.32 . . . . 0.0 112.488 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.8 166.69 13.35 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.34 2.693 . . . . 0.0 114.219 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.142 1.777 . . . . 0.0 112.948 177.164 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 t . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -90.54 116.78 28.71 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.869 -0.52 . . . . 0.0 111.504 174.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.4 -36.8 84.93 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.877 -0.514 . . . . 0.0 112.079 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -62.22 -45.02 95.2 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.301 0.5 . . . . 0.0 111.69 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -61.24 -43.43 98.88 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.951 0.796 . . . . 0.0 112.044 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.77 -44.66 89.32 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 176.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.35 -51.12 70.12 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.228 1.011 . . . . 0.0 112.635 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -60.14 -40.58 90.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.26 1.391 . . . . 0.0 112.043 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -54.51 46.32 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.464 1.106 . . . . 0.0 111.745 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.2 m -64.7 -40.1 94.8 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.187 -0.946 . . . . 0.0 112.514 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -70.32 -21.55 62.9 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.994 -1.066 . . . . 0.0 112.895 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -66.85 -27.1 67.26 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.511 1.051 . . . . 0.0 111.4 170.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -83.83 -43.14 15.68 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.667 1.187 . . . . 0.0 111.166 169.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 139.63 10.5 0.79 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 117.047 1.579 . . . . 0.0 117.047 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -129.79 170.91 13.27 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.074 1.937 . . . . 0.0 111.811 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.0 mt -71.8 163.32 28.03 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.06 0.846 . . . . 0.0 112.014 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.68 149.86 18.76 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.682 1.135 . . . . 0.0 113.862 169.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -135.84 134.35 38.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.507 2.323 . . . . 0.0 110.733 171.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 34.6 m -82.52 150.52 26.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -135.86 83.35 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 124.879 1.272 . . . . 0.0 108.157 175.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.81 -80.82 0.09 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 125.644 1.592 . . . . 0.0 113.151 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -125.22 -5.41 7.26 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.629 1.572 . . . . 0.0 113.898 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -97.2 163.01 13.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.544 1.537 . . . . 0.0 111.659 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.6 t -120.09 147.82 44.37 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.196 1.398 . . . . 0.0 111.631 174.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.18 146.95 31.96 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.768 1.627 . . . . 0.0 111.025 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -105.39 137.51 43.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.322 1.049 . . . . 0.0 111.893 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.47 153.58 76.27 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.953 1.301 . . . . 0.0 113.191 -169.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -72.16 155.43 56.62 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.949 2.433 . . . . 0.0 115.563 -176.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.105 1.762 . . . . 0.0 111.033 168.131 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.546 0.795 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -89.16 69.11 8.28 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.146 0.978 . . . . 0.0 111.039 169.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.43 -46.22 76.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.864 0.866 . . . . 0.0 112.692 -172.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -63.66 -44.03 95.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.324 0.966 . . . . 0.0 112.236 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -59.94 -42.47 94.1 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 119.228 0.922 . . . . 0.0 111.962 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.3 t -62.84 -47.75 82.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.082 1.353 . . . . 0.0 112.304 177.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.75 -53.82 53.33 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.777 0.831 . . . . 0.0 111.824 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -58.99 -36.77 75.46 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 121.283 -0.885 . . . . 0.0 112.252 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.4 t -65.24 -50.74 64.67 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.781 1.233 . . . . 0.0 112.425 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.3 m -68.35 -37.91 80.95 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.104 0.962 . . . . 0.0 112.242 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -65.67 -22.75 66.66 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.838 -1.164 . . . . 0.0 113.659 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.7 t -65.3 -37.0 85.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.713 0.805 . . . . 0.0 111.318 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -75.56 -43.07 50.43 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.904 1.282 . . . . 0.0 111.218 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 141.33 9.27 0.67 Allowed Glycine 0 CA--C 1.539 1.533 0 N-CA-C 116.659 1.423 . . . . 0.0 116.659 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -141.55 171.58 13.86 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.448 1.624 . . . . 0.0 112.228 -174.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -77.05 167.13 22.33 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.62 0.768 . . . . 0.0 112.836 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.47 132.82 10.17 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.322 1.439 . . . . 0.0 111.164 168.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -137.77 140.0 40.38 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 119.198 1.499 . . . . 0.0 112.711 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.6 t -82.7 139.33 33.72 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.903 1.281 . . . . 0.0 113.804 -172.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.9 mt -128.41 103.28 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 126.635 1.974 . . . . 0.0 107.528 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.55 -98.24 0.74 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.592 1.091 . . . . 0.0 112.813 -175.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -128.2 3.87 5.79 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.083 2.153 . . . . 0.0 112.966 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -117.43 151.42 37.1 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.528 1.531 . . . . 0.0 110.787 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.4 t -126.29 149.38 49.17 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.158 -0.963 . . . . 0.0 112.218 -175.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 152.16 38.67 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.443 1.497 . . . . 0.0 112.434 -171.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.0 m -87.04 134.93 33.45 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.114 0.966 . . . . 0.0 113.575 -172.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 m -145.85 150.45 42.82 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.738 1.615 . . . . 0.0 113.834 -170.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.95 159.11 48.74 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.022 3.148 . . . . 0.0 114.85 -175.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.233 1.813 . . . . 0.0 111.672 169.282 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.7 t . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -67.2 89.97 0.2 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.08 1.352 . . . . 0.0 111.353 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -71.59 -38.76 70.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.602 1.561 . . . . 0.0 112.33 -173.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.87 -45.39 78.25 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.192 -0.942 . . . . 0.0 112.629 -178.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -59.8 -36.32 76.5 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-N 119.046 0.839 . . . . 0.0 111.621 177.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.2 t -67.57 -46.17 73.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.668 1.587 . . . . 0.0 113.28 174.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -57.66 -47.81 81.25 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.146 1.339 . . . . 0.0 112.393 175.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 45.5 mt -59.92 -41.0 90.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.282 1.033 . . . . 0.0 111.532 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.6 t -64.52 -48.1 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.688 1.195 . . . . 0.0 112.893 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.5 m -68.98 -27.51 65.78 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.082 -1.012 . . . . 0.0 112.327 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -59.19 -34.77 72.53 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.089 -1.007 . . . . 0.0 112.137 175.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 m -67.63 -18.93 65.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.411 1.084 . . . . 0.0 113.639 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.2 mt -98.54 -3.9 35.4 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.852 2.061 . . . . 0.0 112.639 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.87 57.59 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.72 1.628 . . . . 0.0 115.892 175.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -144.54 176.13 9.62 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.581 1.691 . . . . 0.0 113.578 -178.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.21 172.33 13.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.858 1.263 . . . . 0.0 112.634 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.46 122.45 2.64 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.674 1.131 . . . . 0.0 111.446 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -119.61 148.01 43.85 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.369 1.467 . . . . 0.0 112.307 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.9 t -78.72 127.42 32.05 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.061 0.545 . . . . 0.0 112.454 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -132.18 100.99 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.99 1.316 . . . . 0.0 109.057 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.27 -124.26 15.96 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 121.495 -0.753 . . . . 0.0 111.607 -172.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -88.94 -2.75 58.74 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -137.54 133.45 34.53 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.661 1.184 . . . . 0.0 113.291 -171.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.7 t -88.36 139.63 30.29 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.434 1.094 . . . . 0.0 111.729 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.31 154.46 50.07 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.941 1.296 . . . . 0.0 111.809 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.9 m -78.88 136.62 37.35 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.4 m -148.75 154.29 40.3 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.69 1.596 . . . . 0.0 113.393 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.12 164.05 36.31 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.124 3.216 . . . . 0.0 114.089 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 126.516 1.927 . . . . 0.0 112.992 -177.902 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t . . . . . 0 CA--C 1.545 0.769 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -108.94 81.83 1.51 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.844 1.658 . . . . 0.0 109.291 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.2 tp -64.98 -40.21 94.62 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.367 1.067 . . . . 0.0 112.41 -170.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -63.06 -46.33 87.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.202 175.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -61.4 -36.64 80.87 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 119.807 1.185 . . . . 0.0 112.312 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.5 -42.44 95.84 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.735 0.814 . . . . 0.0 112.633 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.33 -48.0 83.62 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.066 -1.021 . . . . 0.0 112.22 173.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 mt -62.55 -34.34 76.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.199 1.0 . . . . 0.0 112.327 177.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 t -66.93 -54.75 18.93 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.419 1.488 . . . . 0.0 112.316 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.3 m -71.67 -26.0 62.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.564 0.746 . . . . 0.0 112.944 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -54.45 -38.42 66.32 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.188 1.395 . . . . 0.0 112.411 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.7 m -74.81 -13.57 60.59 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 178.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.8 mt -92.42 -20.5 20.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.172 1.389 . . . . 0.0 111.988 169.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.28 24.23 10.5 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.154 1.359 . . . . 0.0 115.287 178.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -146.15 173.48 12.17 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 118.795 1.297 . . . . 0.0 112.913 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 mt -76.29 162.77 27.64 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.26 1.024 . . . . 0.0 112.361 -177.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -127.72 128.07 5.98 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.517 1.056 . . . . 0.0 112.815 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -123.64 159.18 29.86 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.214 2.206 . . . . 0.0 111.834 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.7 m -92.41 127.48 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.707 0.803 . . . . 0.0 110.368 168.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -132.82 112.94 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.48 36.29 90.9 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 121.532 -0.73 . . . . 0.0 112.03 -169.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.25 6.6 mp0 61.0 10.52 2.87 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -178.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -111.35 138.26 48.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.291 1.437 . . . . 0.0 110.36 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.9 t -63.39 130.37 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.809 1.244 . . . . 0.0 112.986 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.72 130.67 47.45 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.169 1.787 . . . . 0.0 110.365 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -87.95 136.48 32.95 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.945 -0.472 . . . . 0.0 111.455 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.94 145.85 52.4 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.183 1.393 . . . . 0.0 112.001 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.49 149.39 91.13 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.934 2.423 . . . . 0.0 113.422 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.325 1.05 . . . . 0.0 111.154 169.589 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 t . . . . . 0 CA--C 1.542 0.641 0 CA-C-O 120.722 0.296 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -76.59 127.24 32.43 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.156 0.982 . . . . 0.0 110.332 172.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.31 -45.61 83.65 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.077 -176.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.1 tpp85 -63.88 -42.23 97.53 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.608 1.095 . . . . 0.0 112.736 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 25.3 ttp85 -54.77 -39.83 68.78 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.104 0.865 . . . . 0.0 111.738 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -70.5 -47.02 62.52 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.929 0.892 . . . . 0.0 112.862 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -56.86 -42.93 80.61 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.68 1.192 . . . . 0.0 112.996 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.6 mt -66.24 -33.87 76.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.749 0.704 . . . . 0.0 112.143 176.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.5 p -66.14 -31.91 73.05 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -87.38 -25.08 24.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.278 1.031 . . . . 0.0 113.335 177.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -56.45 -34.14 66.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.367 1.067 . . . . 0.0 110.973 169.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 m -60.02 -20.53 58.33 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.466 1.506 . . . . 0.0 113.404 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.1 mt -107.31 -13.21 15.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.703 1.601 . . . . 0.0 113.775 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.23 14.83 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.264 1.411 . . . . 0.0 116.237 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.91 -177.22 5.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.097 1.449 . . . . 0.0 112.842 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 mt -74.53 162.56 28.68 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.053 0.941 . . . . 0.0 112.195 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.74 147.92 18.69 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 124.432 1.015 . . . . 0.0 111.959 169.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -147.19 139.35 24.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.407 1.883 . . . . 0.0 111.221 -177.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.98 116.18 27.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.13 0.572 . . . . 0.0 110.435 176.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.7 mt -102.54 109.55 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.487 1.115 . . . . 0.0 108.407 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 -84.2 0.18 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.204 0.906 . . . . 0.0 112.625 -178.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.52 21.97 2.18 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.316 1.446 . . . . 0.0 114.108 171.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -140.56 139.75 35.04 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.908 -1.12 . . . . 0.0 112.979 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.61 139.53 51.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.091 1.356 . . . . 0.0 113.662 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.11 48.39 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.473 1.909 . . . . 0.0 110.332 169.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -102.37 103.08 13.48 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.273 0.629 . . . . 0.0 111.141 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 m -90.21 147.52 37.13 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 123.74 0.816 . . . . 0.0 112.153 -176.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -68.57 163.96 34.83 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.838 2.358 . . . . 0.0 112.982 170.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 C--O 1.254 1.334 0 CA-C-O 117.305 -1.331 . . . . 0.0 113.19 173.855 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.544 0.719 0 CA-C-O 120.565 0.222 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -87.27 113.64 23.18 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.65 0.78 . . . . 0.0 109.848 170.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.04 -41.35 78.5 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.408 1.083 . . . . 0.0 112.641 -176.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.4 mmp_? -58.68 -51.49 69.71 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.169 0.895 . . . . 0.0 112.053 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpm_? -61.48 -38.4 87.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.248 0.619 . . . . 0.0 111.415 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.5 t -63.82 -46.55 84.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.259 1.024 . . . . 0.0 113.084 173.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -57.47 -45.44 84.8 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.566 1.076 . . . . 0.0 112.503 175.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.0 mt -70.58 -33.33 70.98 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.939 0.895 . . . . 0.0 111.922 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 t -65.98 -46.01 79.59 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.581 0.352 . . . . 0.0 111.604 171.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.23 -26.46 68.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.735 -1.228 . . . . 0.0 112.955 175.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -60.33 -30.24 69.39 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.822 -1.174 . . . . 0.0 112.224 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.2 m -68.35 -15.28 63.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 171.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.6 mt -105.15 -10.02 17.39 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.964 1.706 . . . . 0.0 112.893 174.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.71 7.2 39.59 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.726 2.108 . . . . 0.0 116.59 174.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.11 179.71 7.04 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.218 2.009 . . . . 0.0 114.347 -170.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.46 168.54 18.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.943 1.297 . . . . 0.0 112.497 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.57 148.79 19.64 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 124.629 1.109 . . . . 0.0 113.567 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -133.11 151.15 52.02 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.869 2.467 . . . . 0.0 110.772 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 93.2 m -99.31 141.77 31.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.108 0.956 . . . . 0.0 113.395 175.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.9 mt -126.31 172.01 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 C-N-CA 129.64 3.176 . . . . 0.0 106.96 173.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.33 102.81 0.09 OUTLIER Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.409 -1.432 . . . . 0.0 113.842 178.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 51.69 35.4 14.95 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 114.444 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -148.36 134.45 19.26 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.554 1.141 . . . . 0.0 112.299 -177.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.5 t -96.32 134.83 38.97 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.283 1.433 . . . . 0.0 110.408 169.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.33 131.48 43.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.009 1.324 . . . . 0.0 111.898 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -91.44 142.55 27.55 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.909 0.884 . . . . 0.0 111.956 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.25 151.0 57.25 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 125.656 1.582 . . . . 0.0 112.334 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.66 160.8 47.15 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.143 2.562 . . . . 0.0 112.984 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.176 1.39 . . . . 0.0 112.649 175.89 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -83.89 161.65 20.79 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.121 0.969 . . . . 0.0 113.385 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.6 m -62.93 118.7 8.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.868 1.667 . . . . 0.0 113.368 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.01 68.67 8.49 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.536 -0.728 . . . . 0.0 110.1 166.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.9 tp -50.54 -32.21 17.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.63 1.572 . . . . 0.0 113.379 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -59.01 -54.26 49.15 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.931 0.892 . . . . 0.0 112.191 171.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -67.61 -28.68 67.95 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.152 0.887 . . . . 0.0 112.471 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 79.6 m -66.31 -46.47 76.8 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 124.691 1.197 . . . . 0.0 112.163 170.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.97 -43.1 86.29 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.36 -0.829 . . . . 0.0 112.346 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.65 -50.52 72.9 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.118 0.872 . . . . 0.0 111.828 173.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.7 m -62.73 -41.31 99.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.495 0.718 . . . . 0.0 112.212 -176.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.0 m -77.8 -21.66 51.26 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 176.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -59.68 -36.04 75.68 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 120.074 1.307 . . . . 0.0 111.842 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -61.9 -24.85 67.2 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.1 mt -93.93 -4.47 49.76 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.814 1.646 . . . . 0.0 112.765 177.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.35 14.32 60.36 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.086 1.803 . . . . 0.0 116.333 176.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -150.23 178.8 8.65 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 119.872 1.836 . . . . 0.0 114.595 -172.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.9 mt -72.09 168.91 17.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.524 1.53 . . . . 0.0 112.144 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.84 59.97 0.64 Allowed Glycine 0 N--CA 1.474 1.197 0 C-N-CA 126.306 1.908 . . . . 0.0 113.868 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -66.06 148.67 51.46 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.57 1.948 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.4 t -86.35 120.09 27.33 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.727 0.811 . . . . 0.0 111.709 175.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.1 mt -131.8 112.71 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 125.079 1.352 . . . . 0.0 109.509 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.45 39.54 97.83 Favored Glycine 0 CA--C 1.535 1.288 0 O-C-N 121.426 -0.796 . . . . 0.0 112.659 -175.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.61 22.13 12.57 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.052 1.741 . . . . 0.0 115.352 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -139.33 149.15 43.87 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.123 1.769 . . . . 0.0 110.296 167.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.4 m -79.45 156.97 27.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -150.72 138.43 19.81 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.921 1.689 . . . . 0.0 110.599 171.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 21.8 m -82.6 129.99 35.04 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.227 -0.921 . . . . 0.0 111.745 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.4 m -148.97 155.79 40.53 Favored Pre-proline 0 N--CA 1.484 1.244 0 C-N-CA 125.859 1.664 . . . . 0.0 113.472 -173.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -67.43 163.2 35.64 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 123.888 3.059 . . . . 0.0 115.231 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 . . . . . 0 C--O 1.254 1.323 0 C-N-CA 127.243 2.217 . . . . 0.0 114.321 177.08 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.603 0.24 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -60.9 156.38 17.58 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -168.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.2 p -59.0 167.43 1.64 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 126.82 2.048 . . . . 0.0 116.249 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -92.68 87.51 5.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.743 1.617 . . . . 0.0 108.896 168.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.8 tp -67.42 -38.68 84.97 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.755 0.822 . . . . 0.0 112.804 -170.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -65.23 -42.74 93.09 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.655 1.116 . . . . 0.0 112.333 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -55.3 -41.92 72.99 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.369 0.986 . . . . 0.0 111.845 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -64.57 -50.07 68.7 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.372 0.669 . . . . 0.0 111.531 176.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -60.02 -42.05 93.48 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.745 -1.222 . . . . 0.0 113.725 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 86.3 mt -64.83 -48.97 72.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.639 1.109 . . . . 0.0 111.775 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 79.1 p -67.35 -32.57 73.6 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m -73.07 -29.13 62.73 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.491 1.041 . . . . 0.0 113.359 170.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.87 -38.74 89.44 Favored 'General case' 0 N--CA 1.478 0.956 0 O-C-N 120.848 -1.158 . . . . 0.0 111.424 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.9 m -56.05 -33.2 64.77 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.659 0.783 . . . . 0.0 112.266 173.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.5 mt -84.71 -13.34 51.67 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.166 1.387 . . . . 0.0 112.751 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.83 23.18 13.99 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-O 118.577 -1.124 . . . . 0.0 115.829 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -155.31 176.12 12.99 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 119.01 1.405 . . . . 0.0 113.433 -177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.3 mt -76.82 169.74 17.76 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.301 1.441 . . . . 0.0 113.436 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.89 134.52 9.93 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 110.618 167.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -125.04 136.99 54.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.756 1.622 . . . . 0.0 113.384 172.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.1 t -70.53 127.36 32.44 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.896 1.678 . . . . 0.0 110.376 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 83.1 mt -87.71 -31.34 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.119 1.368 . . . . 0.0 111.831 176.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.93 -102.54 0.19 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 128.114 2.768 . . . . 0.0 110.988 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -74.83 -21.98 58.96 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.801 -0.823 . . . . 0.0 112.698 171.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.59 167.52 11.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.6 1.96 . . . . 0.0 110.918 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 152.49 47.81 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.257 1.423 . . . . 0.0 111.284 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.29 154.99 43.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 33.3 m -79.48 137.59 37.27 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.3 m -149.59 156.29 38.97 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 126.078 1.751 . . . . 0.0 112.302 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -62.69 168.65 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.93 3.087 . . . . 0.0 115.23 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 . . . . . 0 C--O 1.249 1.054 0 C-N-CA 126.664 1.986 . . . . 0.0 112.342 174.049 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 120.638 0.256 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -94.04 144.35 25.55 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.844 0.857 . . . . 0.0 111.518 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.2 t -77.99 120.57 23.03 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.144 0.578 . . . . 0.0 112.532 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -74.85 69.8 1.88 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.536 1.135 . . . . 0.0 112.341 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 67.5 tp -55.13 -45.23 75.56 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.709 1.603 . . . . 0.0 112.568 -175.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -61.21 -47.23 87.08 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.387 0.675 . . . . 0.0 112.129 178.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 38.6 ttp180 -58.79 -40.71 84.81 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.375 0.67 . . . . 0.0 111.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.06 -50.29 64.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.61 1.164 . . . . 0.0 112.691 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -59.81 -38.14 81.14 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 120.633 -1.292 . . . . 0.0 113.2 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.36 -34.59 78.5 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.032 0.833 . . . . 0.0 112.395 173.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.1 t -65.55 -45.55 82.96 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.459 0.304 . . . . 0.0 111.7 170.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 30.4 m -70.19 -28.38 65.26 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.4 mtp180 -58.62 -32.49 69.07 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.663 1.185 . . . . 0.0 113.161 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.4 m -78.3 0.51 25.12 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 175.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.4 mt -123.83 -3.19 8.21 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 127.147 2.179 . . . . 0.0 113.577 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 13.67 58.92 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.62 1.581 . . . . 0.0 116.969 173.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -145.72 -179.58 6.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.826 1.813 . . . . 0.0 114.54 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 69.0 mt -83.08 169.87 15.42 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.385 1.474 . . . . 0.0 112.825 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.89 129.41 6.56 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.01 1.291 . . . . 0.0 112.038 169.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -124.04 141.81 51.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.962 1.305 . . . . 0.0 113.5 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 99.4 m -81.73 146.06 30.17 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.448 1.499 . . . . 0.0 112.505 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.0 mt -103.74 -26.61 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-O 123.466 1.603 . . . . 0.0 112.804 -177.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.34 -48.92 0.21 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 128.08 2.752 . . . . 0.0 111.832 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -139.18 -18.55 1.0 Allowed 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 169.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -101.53 166.94 10.45 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.589 1.555 . . . . 0.0 110.614 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.5 t -136.17 160.31 39.05 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.986 1.314 . . . . 0.0 112.673 -173.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.29 150.28 35.45 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.341 1.456 . . . . 0.0 112.181 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.7 m -81.03 136.31 35.96 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -149.72 154.05 37.16 Favored Pre-proline 0 N--CA 1.481 1.086 0 C-N-CA 126.108 1.763 . . . . 0.0 113.256 -169.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -72.93 164.1 36.5 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.284 3.323 . . . . 0.0 113.949 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 C--O 1.258 1.502 0 C-N-CA 126.232 1.813 . . . . 0.0 113.946 -177.053 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 119.598 -0.239 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -138.47 140.34 39.18 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.272 1.829 . . . . 0.0 110.603 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.3 m -88.77 109.7 20.39 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.487 1.039 . . . . 0.0 113.497 -179.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.36 73.17 7.25 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 166.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.7 tp -57.95 -38.63 76.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -167.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -58.98 -52.48 65.58 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.259 0.936 . . . . 0.0 110.996 172.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -57.1 -42.54 80.96 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 118.913 0.779 . . . . 0.0 112.79 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 89.4 m -63.62 -38.7 92.11 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.258 1.023 . . . . 0.0 112.691 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -62.43 -46.99 86.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.121 -0.987 . . . . 0.0 112.564 171.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 77.0 mt -58.5 -44.25 89.39 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.111 0.869 . . . . 0.0 111.06 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.9 m -57.22 -54.52 45.85 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.123 0.969 . . . . 0.0 112.234 174.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.3 m -63.16 -37.61 87.9 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.46 1.027 . . . . 0.0 112.794 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -63.81 -23.8 67.5 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 120.599 -1.313 . . . . 0.0 113.745 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 p -66.95 -28.0 67.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 169.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.8 mt -91.13 -5.29 55.28 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.945 2.098 . . . . 0.0 112.757 173.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 100.76 -0.02 55.27 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 126.251 1.881 . . . . 0.0 116.741 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -132.07 177.88 7.22 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 119.918 1.859 . . . . 0.0 113.971 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.0 mt -78.8 163.69 25.14 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.565 1.146 . . . . 0.0 113.748 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -123.2 127.07 6.49 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 125.113 1.339 . . . . 0.0 113.076 175.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.2 mmtt -130.87 153.31 49.27 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.141 1.776 . . . . 0.0 111.755 176.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.2 t -82.48 137.1 34.74 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.897 0.879 . . . . 0.0 111.0 170.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 35.1 mt -130.65 91.95 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.681 1.192 . . . . 0.0 108.714 174.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.97 55.71 25.03 Favored Glycine 0 CA--C 1.529 0.964 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.629 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 64.26 2.79 1.59 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 127.467 2.307 . . . . 0.0 116.421 -175.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -118.14 118.65 32.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.168 1.387 . . . . 0.0 111.733 175.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.7 m -62.57 146.11 52.71 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 159.5 43.28 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.305 1.842 . . . . 0.0 111.624 174.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.7 m -100.81 141.11 34.15 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.026 0.93 . . . . 0.0 112.319 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.97 146.53 52.72 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 124.791 1.236 . . . . 0.0 112.034 -175.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -78.84 162.25 26.8 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.897 2.398 . . . . 0.0 112.073 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.257 1.458 0 C-N-CA 126.061 1.744 . . . . 0.0 114.364 178.601 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -70.85 149.92 46.31 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 118.837 0.744 . . . . 0.0 112.823 -174.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.0 p -60.12 135.38 57.7 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -169.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -89.58 76.01 7.42 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.114 0.965 . . . . 0.0 110.066 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.62 -40.75 72.55 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.829 1.252 . . . . 0.0 112.834 -172.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -62.83 -46.99 85.33 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.383 0.992 . . . . 0.0 111.93 175.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -63.2 -38.39 90.97 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 121.232 -0.917 . . . . 0.0 111.726 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -61.1 -44.31 97.55 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.989 0.915 . . . . 0.0 112.349 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.35 -41.4 93.58 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.212 1.005 . . . . 0.0 112.618 174.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -65.66 -42.41 91.38 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.948 1.249 . . . . 0.0 111.909 172.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.0 t -60.52 -32.91 71.92 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.865 0.866 . . . . 0.0 112.315 175.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -81.37 -37.55 28.03 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.137 0.975 . . . . 0.0 113.1 171.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.8 tpp180 -64.13 -28.0 69.47 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 119.986 -1.697 . . . . 0.0 111.889 175.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.8 m -60.2 -22.08 62.52 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.406 1.482 . . . . 0.0 112.087 169.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.8 mt -108.63 1.32 21.22 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 127.968 2.507 . . . . 0.0 113.296 174.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.82 14.06 63.66 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.837 1.684 . . . . 0.0 116.888 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -138.2 175.27 9.72 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.681 2.241 . . . . 0.0 114.6 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.1 mt -81.39 168.87 17.89 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.341 1.056 . . . . 0.0 112.015 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -129.29 140.73 11.94 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 124.918 1.247 . . . . 0.0 112.491 173.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -133.27 141.07 47.82 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.951 1.7 . . . . 0.0 111.534 175.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 48.9 t -72.37 155.39 40.2 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.677 1.591 . . . . 0.0 113.032 -176.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.9 mt -110.37 -28.0 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 125.975 1.71 . . . . 0.0 112.499 172.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 158.9 -75.19 0.2 Allowed Glycine 0 CA--C 1.53 0.987 0 C-N-CA 127.385 2.421 . . . . 0.0 111.726 174.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -94.18 -28.93 15.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.063 0.945 . . . . 0.0 112.51 169.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -106.33 177.9 4.72 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.158 1.383 . . . . 0.0 111.973 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -144.6 160.87 40.45 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.675 1.59 . . . . 0.0 111.561 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.39 154.73 35.05 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.975 0.91 . . . . 0.0 113.007 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.59 152.48 39.26 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.799 1.24 . . . . 0.0 113.982 -175.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -144.47 151.7 51.44 Favored Pre-proline 0 N--CA 1.478 0.953 0 C-N-CA 126.188 1.795 . . . . 0.0 113.006 -176.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -71.25 162.04 43.78 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.48 2.786 . . . . 0.0 112.8 170.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.251 1.169 0 C-N-CA 125.486 1.514 . . . . 0.0 113.39 175.357 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -76.34 151.66 36.59 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -168.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 22.1 t -75.01 124.85 27.72 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.038 1.735 . . . . 0.0 111.094 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -75.37 103.59 5.58 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 118.942 0.792 . . . . 0.0 110.376 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.72 -40.72 95.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.581 0.753 . . . . 0.0 111.993 -177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.0 ttp180 -65.44 -43.15 91.34 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 119.061 0.846 . . . . 0.0 112.396 -175.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -59.82 -35.39 74.61 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.893 1.224 . . . . 0.0 111.346 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.87 -37.46 58.9 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 125.071 1.348 . . . . 0.0 113.804 176.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -58.65 -48.52 80.75 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.645 1.111 . . . . 0.0 111.268 171.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 49.0 mt -61.97 -41.35 97.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.405 1.002 . . . . 0.0 111.732 176.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 64.2 m -61.7 -39.32 91.08 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.418 0.687 . . . . 0.0 112.723 176.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.3 m -80.75 -38.72 28.18 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.163 0.892 . . . . 0.0 113.025 176.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 39.7 mmm-85 -63.54 -22.76 67.07 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.363 -1.461 . . . . 0.0 113.48 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.79 -35.27 76.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.373 0.669 . . . . 0.0 111.376 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.0 mt -86.94 -34.27 19.39 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.835 1.654 . . . . 0.0 112.176 175.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 137.53 -5.53 3.48 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 125.494 1.521 . . . . 0.0 116.236 170.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -126.93 174.39 8.87 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.366 1.583 . . . . 0.0 113.556 -170.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.7 mt -72.58 162.06 29.97 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.976 0.893 . . . . 0.0 112.764 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -126.04 131.12 7.38 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 124.859 1.219 . . . . 0.0 111.253 172.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.3 142.36 50.56 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.994 1.718 . . . . 0.0 112.188 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 56.2 m -83.67 82.44 8.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.22 1.408 . . . . 0.0 111.133 170.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.7 mt -90.03 115.46 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 O-C-N 121.447 -0.783 . . . . 0.0 109.398 -175.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.7 50.47 63.17 Favored Glycine 0 CA--C 1.532 1.104 0 O-C-N 122.114 -0.367 . . . . 0.0 112.494 -176.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 55.75 26.95 10.06 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -177.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.06 144.1 27.66 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.733 -1.229 . . . . 0.0 112.301 170.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 90.6 m -77.17 137.82 39.1 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -170.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -134.46 137.75 44.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.61 1.564 . . . . 0.0 110.465 169.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -81.59 137.24 35.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.974 -0.454 . . . . 0.0 110.709 171.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -142.02 148.26 47.92 Favored Pre-proline 0 N--CA 1.474 0.73 0 C-N-CA 125.19 1.396 . . . . 0.0 111.854 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.3 164.66 33.24 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 123.12 2.547 . . . . 0.0 112.362 174.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.573 1.549 . . . . 0.0 112.776 -179.224 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -67.39 154.18 41.95 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.513 1.672 . . . . 0.0 115.513 -167.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.0 m -56.98 146.89 25.5 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.333 1.453 . . . . 0.0 113.426 174.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 33.2 m120 -89.74 72.54 7.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.19 1.396 . . . . 0.0 109.944 169.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.29 -33.36 70.98 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -168.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -62.82 -51.65 66.23 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.504 1.047 . . . . 0.0 111.561 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -57.39 -41.74 80.83 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.162 0.892 . . . . 0.0 110.984 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.93 -46.37 81.93 Favored 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 124.87 1.268 . . . . 0.0 113.715 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -61.91 -49.69 75.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.099 0.863 . . . . 0.0 112.243 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.91 -38.09 89.82 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.159 0.891 . . . . 0.0 111.754 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.7 t -59.74 -52.75 64.17 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.492 0.717 . . . . 0.0 111.645 174.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.8 m -63.34 -35.35 80.09 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 119.189 0.904 . . . . 0.0 111.863 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -65.03 -26.15 68.14 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.385 -1.447 . . . . 0.0 113.053 176.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.6 p -63.96 -18.97 64.79 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.208 0.913 . . . . 0.0 112.848 169.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.0 mt -107.35 -5.81 17.54 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.649 2.38 . . . . 0.0 113.599 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.93 16.38 30.87 Favored Glycine 0 CA--C 1.541 1.677 0 N-CA-C 117.235 1.654 . . . . 0.0 117.235 173.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -144.65 169.85 17.21 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 119.577 1.688 . . . . 0.0 112.868 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.1 mt -77.21 165.86 23.98 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 120.998 -1.064 . . . . 0.0 113.167 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.93 140.82 13.94 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.997 1.284 . . . . 0.0 111.492 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt -140.47 158.67 43.66 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.579 1.952 . . . . 0.0 112.142 176.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.8 t -90.6 132.28 35.83 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.31 1.044 . . . . 0.0 112.86 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 69.7 mt -121.74 103.21 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 125.625 1.57 . . . . 0.0 108.321 172.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 58.1 48.7 81.28 Favored Glycine 0 CA--C 1.534 1.252 0 C-N-CA 123.896 0.76 . . . . 0.0 113.966 176.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.276 79.5 mt-10 64.44 27.3 13.56 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 116.501 2.037 . . . . 0.0 116.501 -175.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -146.49 143.07 28.69 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 120.372 -1.455 . . . . 0.0 110.792 166.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 86.3 m -84.66 145.36 28.02 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.269 1.951 . . . . 0.0 116.269 -169.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.07 146.98 52.41 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.237 2.215 . . . . 0.0 111.656 174.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.8 m -92.0 138.53 31.46 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.51 0.724 . . . . 0.0 111.23 175.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 m -147.53 153.39 43.55 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 111.34 -169.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -73.8 155.71 48.73 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.942 2.428 . . . . 0.0 113.408 -175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 C--O 1.254 1.308 0 C-N-CA 125.415 1.486 . . . . 0.0 113.127 169.796 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.208 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -93.66 169.22 10.49 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.345 1.458 . . . . 0.0 113.018 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 p -87.18 174.24 8.74 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.876 2.07 . . . . 0.0 114.365 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -75.59 68.25 2.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.233 1.013 . . . . 0.0 111.209 167.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 tp -49.97 -49.59 49.8 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.452 1.501 . . . . 0.0 112.958 -174.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.4 tpp85 -61.84 -38.77 89.44 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 119.195 0.907 . . . . 0.0 112.799 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -65.85 -38.11 87.99 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.793 -0.567 . . . . 0.0 111.895 175.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.5 m -75.43 -30.9 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 124.737 1.215 . . . . 0.0 113.818 178.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -56.71 -43.75 80.9 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.51 1.05 . . . . 0.0 110.916 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.3 mt -64.53 -43.71 93.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.235 1.014 . . . . 0.0 112.014 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.8 m -60.83 -37.88 83.54 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.78 -25.61 61.23 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.198 -0.939 . . . . 0.0 112.81 173.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -60.06 -39.19 85.17 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.742 -1.224 . . . . 0.0 110.903 171.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -58.68 -23.26 59.08 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.749 0.82 . . . . 0.0 112.967 173.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.48 -8.4 23.19 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.763 1.625 . . . . 0.0 113.922 176.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.51 33.78 13.02 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.32 1.438 . . . . 0.0 115.205 175.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -155.37 -178.24 7.12 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.969 1.308 . . . . 0.0 112.621 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 38.2 mt -85.0 168.23 15.12 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.596 1.158 . . . . 0.0 112.953 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.71 146.59 17.6 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.692 1.139 . . . . 0.0 115.056 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -138.32 163.34 32.07 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 128.146 2.578 . . . . 0.0 111.942 173.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.76 154.39 22.43 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 172.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mt -136.49 91.98 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 127.915 2.486 . . . . 0.0 105.581 166.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.8 -128.09 31.59 Favored Glycine 0 CA--C 1.536 1.352 0 O-C-N 121.456 -0.778 . . . . 0.0 111.158 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.2 mp0 -84.97 -4.99 59.35 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.974 1.31 . . . . 0.0 114.339 171.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -100.59 177.47 5.0 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.168 1.787 . . . . 0.0 112.524 175.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 64.3 m -121.82 161.86 21.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.915 1.286 . . . . 0.0 113.479 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.74 154.58 36.57 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.049 1.739 . . . . 0.0 111.031 169.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 54.5 m -95.28 148.69 22.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.418 0.687 . . . . 0.0 112.676 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -141.95 151.96 60.74 Favored Pre-proline 0 N--CA 1.482 1.146 0 C-N-CA 126.176 1.79 . . . . 0.0 112.411 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.23 158.42 57.73 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.993 2.462 . . . . 0.0 113.868 178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.458 1.903 . . . . 0.0 112.906 176.243 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -68.06 140.06 56.27 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.771 0.796 . . . . 0.0 113.067 -176.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.8 t -66.34 132.71 48.96 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.119 1.368 . . . . 0.0 111.069 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -90.81 120.16 31.62 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.778 -1.201 . . . . 0.0 110.984 174.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -74.09 -48.95 26.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.482 0.713 . . . . 0.0 112.696 -179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.7 ttp180 -62.74 -43.4 98.89 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 121.198 -0.939 . . . . 0.0 112.354 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -59.27 -37.7 78.28 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 118.867 0.758 . . . . 0.0 111.099 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.4 m -72.43 -36.83 68.68 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.12 1.368 . . . . 0.0 114.395 174.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -58.56 -47.44 84.24 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.701 1.592 . . . . 0.0 111.733 171.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -65.55 -36.32 83.44 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.626 1.17 . . . . 0.0 112.5 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -49.18 68.85 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.996 0.918 . . . . 0.0 111.965 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.5 m -65.84 -23.32 66.65 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 121.191 -0.943 . . . . 0.0 112.772 175.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -62.33 -31.65 72.3 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 120.656 -1.277 . . . . 0.0 113.195 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.7 m -67.97 -26.36 65.89 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 169.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.4 mt -85.68 -7.07 59.02 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.244 1.017 . . . . 0.0 112.614 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.29 21.06 39.47 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.842 1.687 . . . . 0.0 115.575 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -149.89 -179.71 7.35 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 119.695 1.748 . . . . 0.0 113.598 -177.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.8 mt -81.37 170.65 15.73 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.161 1.384 . . . . 0.0 112.09 -178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.49 141.92 12.81 Favored Glycine 0 N--CA 1.472 1.06 0 C-N-CA 124.647 1.117 . . . . 0.0 113.547 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -129.19 151.34 49.96 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 127.007 2.123 . . . . 0.0 111.912 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 m -97.05 135.34 39.18 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.851 1.26 . . . . 0.0 110.672 169.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.6 mt -136.53 110.81 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.788 0.835 . . . . 0.0 109.219 175.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.84 -127.22 43.84 Favored Glycine 0 CA--C 1.532 1.149 0 N-CA-C 110.451 -1.059 . . . . 0.0 110.451 -170.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -83.33 -2.33 55.47 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -152.52 155.83 38.2 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 120.886 1.675 . . . . 0.0 115.355 -170.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -88.08 160.87 17.63 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -142.81 145.17 32.95 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.353 1.861 . . . . 0.0 111.55 168.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.5 m -91.46 143.59 26.44 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.718 0.807 . . . . 0.0 112.026 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.6 m -141.63 149.5 54.0 Favored Pre-proline 0 N--CA 1.48 1.059 0 C-N-CA 125.266 1.426 . . . . 0.0 112.744 -168.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.24 156.07 65.79 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.417 2.745 . . . . 0.0 113.407 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.256 1.422 . . . . 0.0 111.846 171.487 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.555 0.217 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -56.84 145.35 29.9 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.452 1.101 . . . . 0.0 113.395 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.2 p -79.51 148.61 31.75 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -176.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -99.73 114.3 27.33 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.295 1.038 . . . . 0.0 110.193 169.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 tt -58.46 -42.64 87.91 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -175.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 tpp85 -61.42 -41.57 97.37 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.742 0.701 . . . . 0.0 112.624 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -60.26 -38.7 84.35 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.235 0.925 . . . . 0.0 111.454 175.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 87.9 m -68.78 -37.8 79.57 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 123.939 0.896 . . . . 0.0 112.634 174.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -59.15 -45.4 91.07 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.381 1.446 . . . . 0.0 112.911 171.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.4 mt -69.63 -31.02 68.88 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.793 0.837 . . . . 0.0 112.453 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 -39.85 82.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.695 0.798 . . . . 0.0 112.344 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.5 m -71.21 -22.03 62.06 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.348 -0.845 . . . . 0.0 112.459 170.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -64.61 -30.77 71.79 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 120.508 -1.37 . . . . 0.0 112.225 174.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.7 m -65.69 -9.36 26.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.563 1.145 . . . . 0.0 113.473 168.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.3 mt -119.36 -6.81 10.29 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.184 2.193 . . . . 0.0 112.939 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.52 29.47 24.29 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.058 1.313 . . . . 0.0 116.039 176.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.87 -179.94 7.9 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.276 1.538 . . . . 0.0 113.55 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.04 176.72 7.49 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.03 1.732 . . . . 0.0 111.826 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.73 151.01 22.42 Favored Glycine 0 CA--C 1.533 1.164 0 N-CA-C 116.245 1.258 . . . . 0.0 116.245 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -120.83 164.93 15.88 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.478 2.311 . . . . 0.0 112.014 -177.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.1 t -123.24 129.97 52.1 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.001 1.72 . . . . 0.0 112.377 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -127.26 95.32 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 127.302 2.241 . . . . 0.0 108.019 -174.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 64.1 -85.93 0.06 OUTLIER Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.042 1.306 . . . . 0.0 113.604 -177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -125.91 0.11 7.3 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.262 1.825 . . . . 0.0 114.358 -177.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -132.19 171.43 13.67 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.41 1.884 . . . . 0.0 111.023 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 59.5 m -132.79 167.79 19.53 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -172.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.65 125.89 14.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 178.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.6 m -74.51 143.77 44.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.487 0.715 . . . . 0.0 111.712 171.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.33 150.15 54.01 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 127.204 2.201 . . . . 0.0 111.19 -172.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -73.88 166.52 29.49 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 123.475 2.783 . . . . 0.0 113.652 -177.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 C--O 1.245 0.838 0 C-N-CA 124.438 1.095 . . . . 0.0 110.345 167.835 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -47.19 138.23 7.2 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -167.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 78.3 m -68.18 95.17 0.56 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.494 2.718 . . . . 0.0 113.961 -174.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -80.78 77.28 7.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.505 1.122 . . . . 0.0 108.046 167.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.38 -43.11 54.32 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.497 1.519 . . . . 0.0 114.491 -167.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.84 -47.08 84.93 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.414 1.006 . . . . 0.0 111.975 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.24 -33.44 76.0 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.439 1.095 . . . . 0.0 111.434 178.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.7 t -67.29 -48.27 68.15 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.919 0.888 . . . . 0.0 112.786 170.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -61.53 -43.93 97.97 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.935 -1.103 . . . . 0.0 112.843 177.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.35 -37.69 88.41 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.548 1.067 . . . . 0.0 112.48 176.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.9 t -63.11 -49.67 73.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.821 0.848 . . . . 0.0 111.885 173.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.3 m -67.44 -42.87 82.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.471 -0.768 . . . . 0.0 111.904 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtp85 -64.07 -20.16 65.74 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.294 -1.504 . . . . 0.0 113.886 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.7 t -64.72 -31.29 72.44 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 118.608 0.64 . . . . 0.0 111.881 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.1 mt -88.98 -16.94 30.51 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.911 1.684 . . . . 0.0 112.727 170.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.4 39.97 5.21 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.828 1.68 . . . . 0.0 115.097 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -147.63 171.62 15.33 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 118.846 1.323 . . . . 0.0 112.046 170.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.09 165.14 24.99 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.549 1.14 . . . . 0.0 113.251 -177.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -119.97 136.53 11.73 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 125.242 1.401 . . . . 0.0 112.005 168.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.0 mmtt -132.26 143.07 49.65 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 126.158 1.783 . . . . 0.0 112.024 175.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -81.57 130.62 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.093 0.957 . . . . 0.0 111.586 173.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.405 HG22 ' H ' ' A' ' 23' ' ' GLY . 3.3 mt -93.38 -136.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 125.198 1.399 . . . . 0.0 107.927 171.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.405 ' H ' HG22 ' A' ' 22' ' ' ILE . . . -76.57 81.75 1.09 Allowed Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.68 1.61 . . . . 0.0 112.227 170.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 57.41 31.36 20.08 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.672 1.989 . . . . 0.0 114.245 177.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -152.27 139.93 19.81 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.988 2.115 . . . . 0.0 109.181 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.7 t -96.49 153.62 17.74 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -151.04 157.12 42.43 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.559 1.144 . . . . 0.0 112.927 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.8 m -88.74 139.91 29.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -147.03 151.36 41.15 Favored Pre-proline 0 N--CA 1.484 1.253 0 C-N-CA 126.969 2.108 . . . . 0.0 112.725 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.22 160.98 47.7 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.781 2.987 . . . . 0.0 114.152 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.78 1.632 . . . . 0.0 112.372 175.194 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.769 0 CA-C-O 120.699 0.285 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -136.33 156.36 48.76 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.933 2.093 . . . . 0.0 107.592 172.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 23.1 p -71.05 67.84 0.43 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -172.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -53.29 128.25 27.54 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.308 1.843 . . . . 0.0 113.153 179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.62 -41.44 99.01 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.946 1.298 . . . . 0.0 111.935 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -62.07 -49.63 75.18 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.213 0.915 . . . . 0.0 111.25 176.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.2 mtm105 -59.15 -42.07 89.82 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.629 0.65 . . . . 0.0 111.205 177.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -65.19 -43.18 92.46 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 175.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -57.62 -52.7 64.37 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.304 -0.873 . . . . 0.0 111.431 174.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.78 -37.88 85.98 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 118.985 0.811 . . . . 0.0 112.001 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.06 -42.26 99.01 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.157 0.983 . . . . 0.0 112.301 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.7 m -75.69 -33.39 60.36 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 121.328 -0.858 . . . . 0.0 112.99 175.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -66.5 -16.93 64.51 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 120.252 -1.53 . . . . 0.0 113.408 174.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.7 t -66.21 -22.92 66.36 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.733 1.213 . . . . 0.0 112.437 167.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -98.66 -26.19 14.45 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.277 2.231 . . . . 0.0 112.031 172.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 129.2 -2.41 6.24 Favored Glycine 0 CA--C 1.539 1.54 0 C-N-CA 126.56 2.028 . . . . 0.0 116.787 169.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -134.64 174.18 10.84 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.721 1.761 . . . . 0.0 113.742 -169.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.0 mt -74.2 175.22 7.74 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.074 0.95 . . . . 0.0 112.382 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -155.17 152.79 24.27 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.506 -0.746 . . . . 0.0 114.271 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -127.21 157.75 38.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.399 2.279 . . . . 0.0 110.152 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -82.64 144.09 30.53 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.538 0.608 . . . . 0.0 112.534 172.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -131.82 115.75 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 126.375 1.87 . . . . 0.0 108.746 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.0 -86.28 0.3 Allowed Glycine 0 CA--C 1.534 1.253 0 C-N-CA 124.4 1.0 . . . . 0.0 111.708 -172.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -141.29 14.95 2.22 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.577 1.951 . . . . 0.0 112.772 169.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -125.96 140.19 52.82 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.878 -1.139 . . . . 0.0 112.276 -169.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.5 t -74.66 142.47 44.51 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.29 -0.882 . . . . 0.0 113.028 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.58 132.13 25.41 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.751 1.62 . . . . 0.0 111.163 173.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 28.9 m -88.45 148.54 24.14 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.762 1.225 . . . . 0.0 113.898 -169.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.4 m -142.94 146.9 39.29 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.373 1.869 . . . . 0.0 112.172 -170.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -66.8 153.25 78.58 Favored 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.046 2.498 . . . . 0.0 113.652 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 . . . . . 0 C--O 1.254 1.299 0 CA-C-O 117.933 -1.032 . . . . 0.0 111.225 169.92 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -88.17 169.06 12.23 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.044 0.938 . . . . 0.0 113.199 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.5 t -68.87 126.6 30.27 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.855 1.262 . . . . 0.0 113.819 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -100.96 123.7 45.55 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 166.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.56 -41.4 98.42 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -169.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -57.91 -49.04 78.1 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.022 0.929 . . . . 0.0 111.999 172.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -64.04 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 118.947 -0.549 . . . . 0.0 111.789 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -65.81 -45.12 83.52 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.647 1.179 . . . . 0.0 112.58 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -56.31 -48.93 75.69 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.928 -1.107 . . . . 0.0 111.666 173.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.0 mt -59.65 -42.49 92.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.558 0.743 . . . . 0.0 111.871 175.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.9 t -60.13 -46.83 88.31 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.16 0.584 . . . . 0.0 111.409 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.1 m -73.97 -25.94 60.2 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -60.91 -31.52 71.03 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 120.819 -1.176 . . . . 0.0 112.855 176.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -66.58 -27.85 68.05 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.044 0.937 . . . . 0.0 112.342 172.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.98 -4.11 50.25 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.786 2.034 . . . . 0.0 113.99 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.67 20.81 46.06 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.297 1.427 . . . . 0.0 116.262 173.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -148.9 174.02 12.69 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.154 1.477 . . . . 0.0 113.363 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.5 mt -74.83 168.25 20.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.979 1.312 . . . . 0.0 112.311 -177.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.86 137.07 8.86 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.452 1.025 . . . . 0.0 113.604 176.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -127.36 155.69 43.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 128.075 2.55 . . . . 0.0 111.718 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 70.7 m -94.06 127.23 39.74 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.792 0.437 . . . . 0.0 110.699 169.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.0 mt -143.66 127.33 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 126.532 1.933 . . . . 0.0 109.236 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.09 22.22 70.5 Favored Glycine 0 CA--C 1.542 1.756 0 O-C-N 121.583 -0.698 . . . . 0.0 114.304 -174.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.265 27.0 mt-10 62.32 25.3 15.11 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 126.908 2.083 . . . . 0.0 112.6 -170.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -126.93 160.04 32.23 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.088 2.955 . . . . 0.0 110.386 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.9 t -84.24 139.43 32.37 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 112.468 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.89 130.18 31.31 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.094 1.358 . . . . 0.0 111.026 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -82.19 142.69 31.97 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.563 0.745 . . . . 0.0 110.917 175.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.6 m -139.88 146.49 47.2 Favored Pre-proline 0 N--CA 1.472 0.653 0 C-N-CA 124.309 1.044 . . . . 0.0 112.672 -170.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 150.9 54.46 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.329 2.686 . . . . 0.0 112.93 176.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.213 1.405 . . . . 0.0 111.036 169.214 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -107.41 163.29 13.17 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.332 1.053 . . . . 0.0 109.956 167.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.8 t -101.04 126.07 47.7 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.717 1.207 . . . . 0.0 111.865 175.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -91.55 120.97 32.82 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.458 0.703 . . . . 0.0 109.96 170.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 66.1 tp -67.41 -41.81 84.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.591 0.756 . . . . 0.0 112.627 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.262 0.1 OUTLIER -65.56 -38.75 90.49 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.943 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -69.57 -33.19 72.37 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.48 1.036 . . . . 0.0 112.628 170.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.3 t -63.41 -41.68 98.73 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 119.595 1.089 . . . . 0.0 110.789 175.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.36 -43.02 99.57 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 121.062 -1.024 . . . . 0.0 113.118 171.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.84 -37.62 87.56 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 120.462 1.483 . . . . 0.0 112.882 172.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.4 m -63.16 -48.44 78.4 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.497 1.119 . . . . 0.0 110.472 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 62.5 m -80.35 -26.48 38.65 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.885 1.274 . . . . 0.0 114.346 -177.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -61.86 -33.74 74.74 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 120.385 1.448 . . . . 0.0 112.485 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.1 m -66.19 -11.17 47.99 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.26 1.424 . . . . 0.0 113.815 171.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 31.4 mt -107.96 -1.16 20.88 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.143 2.177 . . . . 0.0 112.288 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.96 0.21 62.13 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.838 2.161 . . . . 0.0 116.609 175.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.56 178.84 7.04 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.486 1.643 . . . . 0.0 114.42 -169.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.7 mt -78.86 161.8 26.5 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 121.203 -0.936 . . . . 0.0 112.778 -176.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.68 139.77 15.88 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 114.671 -1.15 . . . . 0.0 112.999 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 57.5 mmtt -133.16 146.91 51.98 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.039 2.136 . . . . 0.0 109.659 169.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 97.4 m -84.3 134.26 34.52 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 119.38 0.991 . . . . 0.0 110.096 167.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.5 mt -128.86 126.28 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.968 1.707 . . . . 0.0 107.967 177.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.34 -103.04 0.6 Allowed Glycine 0 CA--C 1.531 1.092 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 -169.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 -134.72 21.75 3.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.586 1.554 . . . . 0.0 113.715 173.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -132.95 157.16 45.85 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.284 1.433 . . . . 0.0 111.711 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -71.59 146.57 48.32 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.066 0.936 . . . . 0.0 112.018 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.17 120.28 17.71 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.656 1.982 . . . . 0.0 109.203 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.1 m -81.73 134.57 35.47 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.806 -0.559 . . . . 0.0 110.171 171.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -142.28 151.56 58.61 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 124.999 1.32 . . . . 0.0 112.488 -174.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -62.8 166.69 13.35 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.34 2.693 . . . . 0.0 114.219 172.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 126.142 1.777 . . . . 0.0 112.948 177.164 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 110.692 -0.114 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -60.31 149.61 33.02 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 t -65.01 140.29 58.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.538 1.535 . . . . 0.0 111.801 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -90.54 116.78 28.71 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.869 -0.52 . . . . 0.0 111.504 174.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.4 -36.8 84.93 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.877 -0.514 . . . . 0.0 112.079 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -62.22 -45.02 95.2 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.301 0.5 . . . . 0.0 111.69 177.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -61.24 -43.43 98.88 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.951 0.796 . . . . 0.0 112.044 175.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.77 -44.66 89.32 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 176.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.35 -51.12 70.12 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.228 1.011 . . . . 0.0 112.635 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -60.14 -40.58 90.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.26 1.391 . . . . 0.0 112.043 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -54.51 46.32 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.464 1.106 . . . . 0.0 111.745 175.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.2 m -64.7 -40.1 94.8 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.187 -0.946 . . . . 0.0 112.514 177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -70.32 -21.55 62.9 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.994 -1.066 . . . . 0.0 112.895 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -66.85 -27.1 67.26 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.511 1.051 . . . . 0.0 111.4 170.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -83.83 -43.14 15.68 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.667 1.187 . . . . 0.0 111.166 169.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 139.63 10.5 0.79 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 117.047 1.579 . . . . 0.0 117.047 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -129.79 170.91 13.27 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.074 1.937 . . . . 0.0 111.811 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.0 mt -71.8 163.32 28.03 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.06 0.846 . . . . 0.0 112.014 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.68 149.86 18.76 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.682 1.135 . . . . 0.0 113.862 169.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -135.84 134.35 38.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.507 2.323 . . . . 0.0 110.733 171.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 34.6 m -82.52 150.52 26.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -135.86 83.35 0.54 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 124.879 1.272 . . . . 0.0 108.157 175.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.81 -80.82 0.09 OUTLIER Glycine 0 CA--C 1.532 1.102 0 C-N-CA 125.644 1.592 . . . . 0.0 113.151 -171.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -125.22 -5.41 7.26 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.629 1.572 . . . . 0.0 113.898 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -97.2 163.01 13.09 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.544 1.537 . . . . 0.0 111.659 175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.6 t -120.09 147.82 44.37 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.196 1.398 . . . . 0.0 111.631 174.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.18 146.95 31.96 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.768 1.627 . . . . 0.0 111.025 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -105.39 137.51 43.1 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.322 1.049 . . . . 0.0 111.893 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.7 m -136.47 153.58 76.27 Favored Pre-proline 0 N--CA 1.481 1.093 0 C-N-CA 124.953 1.301 . . . . 0.0 113.191 -169.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -72.16 155.43 56.62 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.949 2.433 . . . . 0.0 115.563 -176.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.105 1.762 . . . . 0.0 111.033 168.131 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 111.3 0.111 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -129.43 151.5 49.99 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.696 1.198 . . . . 0.0 113.268 -178.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -67.16 130.54 43.44 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.176 1.79 . . . . 0.0 112.699 176.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -89.16 69.11 8.28 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.146 0.978 . . . . 0.0 111.039 169.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.43 -46.22 76.7 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.864 0.866 . . . . 0.0 112.692 -172.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -63.66 -44.03 95.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 119.324 0.966 . . . . 0.0 112.236 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -59.94 -42.47 94.1 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 119.228 0.922 . . . . 0.0 111.962 175.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 41.3 t -62.84 -47.75 82.05 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.082 1.353 . . . . 0.0 112.304 177.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -56.75 -53.82 53.33 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.777 0.831 . . . . 0.0 111.824 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -58.99 -36.77 75.46 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 121.283 -0.885 . . . . 0.0 112.252 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.4 t -65.24 -50.74 64.67 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.781 1.233 . . . . 0.0 112.425 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 80.3 m -68.35 -37.91 80.95 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.104 0.962 . . . . 0.0 112.242 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -65.67 -22.75 66.66 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 120.838 -1.164 . . . . 0.0 113.659 -179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.7 t -65.3 -37.0 85.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.713 0.805 . . . . 0.0 111.318 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.5 mt -75.56 -43.07 50.43 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.904 1.282 . . . . 0.0 111.218 176.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 141.33 9.27 0.67 Allowed Glycine 0 CA--C 1.539 1.533 0 N-CA-C 116.659 1.423 . . . . 0.0 116.659 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -141.55 171.58 13.86 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.448 1.624 . . . . 0.0 112.228 -174.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.1 mt -77.05 167.13 22.33 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.62 0.768 . . . . 0.0 112.836 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.47 132.82 10.17 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 125.322 1.439 . . . . 0.0 111.164 168.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmtt -137.77 140.0 40.38 Favored 'General case' 0 N--CA 1.485 1.31 0 CA-C-N 119.198 1.499 . . . . 0.0 112.711 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.6 t -82.7 139.33 33.72 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.903 1.281 . . . . 0.0 113.804 -172.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 80.9 mt -128.41 103.28 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 126.635 1.974 . . . . 0.0 107.528 171.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.55 -98.24 0.74 Allowed Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.592 1.091 . . . . 0.0 112.813 -175.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -128.2 3.87 5.79 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 127.083 2.153 . . . . 0.0 112.966 177.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -117.43 151.42 37.1 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.528 1.531 . . . . 0.0 110.787 173.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.4 t -126.29 149.38 49.17 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.158 -0.963 . . . . 0.0 112.218 -175.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.34 152.16 38.67 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.443 1.497 . . . . 0.0 112.434 -171.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.0 m -87.04 134.93 33.45 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.114 0.966 . . . . 0.0 113.575 -172.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.3 m -145.85 150.45 42.82 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.738 1.615 . . . . 0.0 113.834 -170.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.95 159.11 48.74 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 124.022 3.148 . . . . 0.0 114.85 -175.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.233 1.813 . . . . 0.0 111.672 169.282 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 111.202 0.075 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -139.97 72.72 1.4 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.533 1.533 . . . . 0.0 110.458 -175.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.7 t 57.71 72.78 0.5 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.684 1.594 . . . . 0.0 113.271 -168.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -67.2 89.97 0.2 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.08 1.352 . . . . 0.0 111.353 178.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -71.59 -38.76 70.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.602 1.561 . . . . 0.0 112.33 -173.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -66.87 -45.39 78.25 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.192 -0.942 . . . . 0.0 112.629 -178.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -59.8 -36.32 76.5 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-N 119.046 0.839 . . . . 0.0 111.621 177.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.2 t -67.57 -46.17 73.45 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.668 1.587 . . . . 0.0 113.28 174.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -57.66 -47.81 81.25 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.146 1.339 . . . . 0.0 112.393 175.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 45.5 mt -59.92 -41.0 90.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.282 1.033 . . . . 0.0 111.532 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 41.6 t -64.52 -48.1 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.688 1.195 . . . . 0.0 112.893 175.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 82.5 m -68.98 -27.51 65.78 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.082 -1.012 . . . . 0.0 112.327 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -59.19 -34.77 72.53 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.089 -1.007 . . . . 0.0 112.137 175.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.5 m -67.63 -18.93 65.14 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.411 1.084 . . . . 0.0 113.639 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 20.2 mt -98.54 -3.9 35.4 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.852 2.061 . . . . 0.0 112.639 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.87 57.59 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.72 1.628 . . . . 0.0 115.892 175.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -144.54 176.13 9.62 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.581 1.691 . . . . 0.0 113.578 -178.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.21 172.33 13.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.858 1.263 . . . . 0.0 112.634 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -136.46 122.45 2.64 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.674 1.131 . . . . 0.0 111.446 172.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -119.61 148.01 43.85 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.369 1.467 . . . . 0.0 112.307 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.9 t -78.72 127.42 32.05 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.061 0.545 . . . . 0.0 112.454 -178.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -132.18 100.99 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.99 1.316 . . . . 0.0 109.057 -178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.27 -124.26 15.96 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 121.495 -0.753 . . . . 0.0 111.607 -172.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -88.94 -2.75 58.74 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 176.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -137.54 133.45 34.53 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.661 1.184 . . . . 0.0 113.291 -171.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.7 t -88.36 139.63 30.29 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.434 1.094 . . . . 0.0 111.729 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.31 154.46 50.07 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.941 1.296 . . . . 0.0 111.809 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.9 m -78.88 136.62 37.35 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -174.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.4 m -148.75 154.29 40.3 Favored Pre-proline 0 N--CA 1.479 1.001 0 C-N-CA 125.69 1.596 . . . . 0.0 113.393 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.12 164.05 36.31 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.124 3.216 . . . . 0.0 114.089 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 126.516 1.927 . . . . 0.0 112.992 -177.902 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 119.54 -0.267 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -145.27 139.68 27.28 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.451 1.501 . . . . 0.0 111.72 175.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.9 t -76.54 111.27 11.83 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 -172.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -108.94 81.83 1.51 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.844 1.658 . . . . 0.0 109.291 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.2 tp -64.98 -40.21 94.62 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.367 1.067 . . . . 0.0 112.41 -170.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -63.06 -46.33 87.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.522 -0.751 . . . . 0.0 111.202 175.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -61.4 -36.64 80.87 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 119.807 1.185 . . . . 0.0 112.312 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -64.5 -42.44 95.84 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.735 0.814 . . . . 0.0 112.633 176.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.33 -48.0 83.62 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.066 -1.021 . . . . 0.0 112.22 173.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 mt -62.55 -34.34 76.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.199 1.0 . . . . 0.0 112.327 177.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.1 t -66.93 -54.75 18.93 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.419 1.488 . . . . 0.0 112.316 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.3 m -71.67 -26.0 62.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.564 0.746 . . . . 0.0 112.944 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -54.45 -38.42 66.32 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.188 1.395 . . . . 0.0 112.411 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.7 m -74.81 -13.57 60.59 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 178.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.8 mt -92.42 -20.5 20.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.172 1.389 . . . . 0.0 111.988 169.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.28 24.23 10.5 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.154 1.359 . . . . 0.0 115.287 178.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -146.15 173.48 12.17 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 118.795 1.297 . . . . 0.0 112.913 178.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.1 mt -76.29 162.77 27.64 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.26 1.024 . . . . 0.0 112.361 -177.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -127.72 128.07 5.98 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.517 1.056 . . . . 0.0 112.815 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -123.64 159.18 29.86 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.214 2.206 . . . . 0.0 111.834 177.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.7 m -92.41 127.48 37.91 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.707 0.803 . . . . 0.0 110.368 168.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.6 mt -132.82 112.94 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.48 36.29 90.9 Favored Glycine 0 CA--C 1.533 1.181 0 O-C-N 121.532 -0.73 . . . . 0.0 112.03 -169.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.25 6.6 mp0 61.0 10.52 2.87 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 116.541 2.052 . . . . 0.0 116.541 -178.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -111.35 138.26 48.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.291 1.437 . . . . 0.0 110.36 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.9 t -63.39 130.37 44.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.809 1.244 . . . . 0.0 112.986 -178.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.72 130.67 47.45 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.169 1.787 . . . . 0.0 110.365 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -87.95 136.48 32.95 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.945 -0.472 . . . . 0.0 111.455 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -136.94 145.85 52.4 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.183 1.393 . . . . 0.0 112.001 -173.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -62.49 149.39 91.13 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.934 2.423 . . . . 0.0 113.422 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.325 1.05 . . . . 0.0 111.154 169.589 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -114.79 144.32 43.69 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.693 1.197 . . . . 0.0 112.593 169.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 t -74.69 122.71 23.66 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.133 1.373 . . . . 0.0 110.596 171.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -76.59 127.24 32.43 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.156 0.982 . . . . 0.0 110.332 172.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.31 -45.61 83.65 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.077 -176.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.1 tpp85 -63.88 -42.23 97.53 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.608 1.095 . . . . 0.0 112.736 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 25.3 ttp85 -54.77 -39.83 68.78 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 119.104 0.865 . . . . 0.0 111.738 173.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -70.5 -47.02 62.52 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.929 0.892 . . . . 0.0 112.862 174.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -56.86 -42.93 80.61 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.68 1.192 . . . . 0.0 112.996 -179.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.6 mt -66.24 -33.87 76.73 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.749 0.704 . . . . 0.0 112.143 176.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.5 p -66.14 -31.91 73.05 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 174.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.9 m -87.38 -25.08 24.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.278 1.031 . . . . 0.0 113.335 177.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -56.45 -34.14 66.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.367 1.067 . . . . 0.0 110.973 169.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 m -60.02 -20.53 58.33 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.466 1.506 . . . . 0.0 113.404 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 21.1 mt -107.31 -13.21 15.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.703 1.601 . . . . 0.0 113.775 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.23 14.83 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 125.264 1.411 . . . . 0.0 116.237 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.91 -177.22 5.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.097 1.449 . . . . 0.0 112.842 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 mt -74.53 162.56 28.68 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.053 0.941 . . . . 0.0 112.195 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.74 147.92 18.69 Favored Glycine 0 N--CA 1.468 0.823 0 C-N-CA 124.432 1.015 . . . . 0.0 111.959 169.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -147.19 139.35 24.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.407 1.883 . . . . 0.0 111.221 -177.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.98 116.18 27.83 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.13 0.572 . . . . 0.0 110.435 176.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 62.7 mt -102.54 109.55 26.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.487 1.115 . . . . 0.0 108.407 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.15 -84.2 0.18 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.204 0.906 . . . . 0.0 112.625 -178.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -141.52 21.97 2.18 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.316 1.446 . . . . 0.0 114.108 171.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -140.56 139.75 35.04 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.908 -1.12 . . . . 0.0 112.979 -178.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.61 139.53 51.42 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.091 1.356 . . . . 0.0 113.662 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.11 48.39 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.473 1.909 . . . . 0.0 110.332 169.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -102.37 103.08 13.48 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.273 0.629 . . . . 0.0 111.141 -176.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.6 m -90.21 147.52 37.13 Favored Pre-proline 0 N--CA 1.473 0.714 0 C-N-CA 123.74 0.816 . . . . 0.0 112.153 -176.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -68.57 163.96 34.83 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 122.838 2.358 . . . . 0.0 112.982 170.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 C--O 1.254 1.334 0 CA-C-O 117.305 -1.331 . . . . 0.0 113.19 173.855 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 120.588 0.232 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -72.15 145.85 47.82 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.43 0.692 . . . . 0.0 112.002 -171.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -63.41 129.34 39.84 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.44 1.496 . . . . 0.0 111.4 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -87.27 113.64 23.18 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.65 0.78 . . . . 0.0 109.848 170.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.04 -41.35 78.5 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.408 1.083 . . . . 0.0 112.641 -176.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.4 mmp_? -58.68 -51.49 69.71 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.169 0.895 . . . . 0.0 112.053 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.5 tpm_? -61.48 -38.4 87.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.248 0.619 . . . . 0.0 111.415 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.5 t -63.82 -46.55 84.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.259 1.024 . . . . 0.0 113.084 173.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -57.47 -45.44 84.8 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.566 1.076 . . . . 0.0 112.503 175.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.0 mt -70.58 -33.33 70.98 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.939 0.895 . . . . 0.0 111.922 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 t -65.98 -46.01 79.59 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.581 0.352 . . . . 0.0 111.604 171.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.23 -26.46 68.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 120.735 -1.228 . . . . 0.0 112.955 175.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -60.33 -30.24 69.39 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.822 -1.174 . . . . 0.0 112.224 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.2 m -68.35 -15.28 63.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 171.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.6 mt -105.15 -10.02 17.39 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.964 1.706 . . . . 0.0 112.893 174.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.71 7.2 39.59 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.726 2.108 . . . . 0.0 116.59 174.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -144.11 179.71 7.04 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.218 2.009 . . . . 0.0 114.347 -170.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.0 mt -80.46 168.54 18.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.943 1.297 . . . . 0.0 112.497 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.57 148.79 19.64 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 124.629 1.109 . . . . 0.0 113.567 -179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -133.11 151.15 52.02 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.869 2.467 . . . . 0.0 110.772 178.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 93.2 m -99.31 141.77 31.66 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.108 0.956 . . . . 0.0 113.395 175.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 81.9 mt -126.31 172.01 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 C-N-CA 129.64 3.176 . . . . 0.0 106.96 173.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -52.33 102.81 0.09 OUTLIER Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.409 -1.432 . . . . 0.0 113.842 178.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 51.69 35.4 14.95 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 114.444 -173.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -148.36 134.45 19.26 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.554 1.141 . . . . 0.0 112.299 -177.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.5 t -96.32 134.83 38.97 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.283 1.433 . . . . 0.0 110.408 169.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -131.33 131.48 43.79 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.009 1.324 . . . . 0.0 111.898 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -91.44 142.55 27.55 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.909 0.884 . . . . 0.0 111.956 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.8 m -142.25 151.0 57.25 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 125.656 1.582 . . . . 0.0 112.334 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -71.66 160.8 47.15 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.143 2.562 . . . . 0.0 112.984 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 125.176 1.39 . . . . 0.0 112.649 175.89 . . . . . . . . 0 0 . 1 stop_ save_